Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NOS1 | P29475 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | FBP1 | P09467 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL556950 | 0.80 | PDPK1 (0.54) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL102331 | 0.76 | PDPK1 (0.59) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL17701190 | 0.74 | PDPK1 (0.43) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL30632310 | 0.73 | PDPK1 (0.56) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL28154527 | 0.73 | PDPK1 (0.56) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL31556353 | 0.73 | PDPK1 (0.56) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL30534095 | 0.73 | PDPK1 (0.56) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL26635219 | 0.73 | ADORA2A (0.49) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL16369869 | 0.73 | PDPK1 (0.38) | PDPK1CYP2A6ADORA2ALOXL2ALDH1A1 | |
| SCHEMBL3093510 | 0.71 | HSP90AA1 (0.52) | PDPK1CYP2A6LOXL2HSP90AA1RAB9A |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110404418-A | A kind of antibacterial ultrafiltration membrane and preparation method thereof | LIU SHANMING | 2019-11-05 | — | — | CN | claimed |
| EP-3686190-A1 | SYNTHESIS OF THERAPEUTICALLY ACTIVE COMPOUNDS | Agios Pharmaceuticals, Inc. (US) | 2020-07-29 | — | — | EP | disclosed |
| CN-110404418-A | A kind of antibacterial ultrafiltration membrane and preparation method thereof | LIU SHANMING | 2019-11-05 | — | — | CN | disclosed |
| CN-110404418-A | A kind of antibacterial ultrafiltration membrane and preparation method thereof | LIU SHANMING | 2019-11-05 | — | — | CN | disclosed |
| CN-110372753-A | Electroluminescent organic material and device | 环球展览公司 | 2019-10-25 | — | — | CN | disclosed |
| CN-110256499-A | Electroluminescent organic material and device | 环球展览公司 | 2019-09-20 | — | — | CN | disclosed |
| CN-110128479-A | Electroluminescent organic material and device | 环球展览公司 | 2019-08-16 | — | — | CN | disclosed |
| CN-110078740-A | Electroluminescent organic material and device | 环球展览公司 | 2019-08-02 | — | — | CN | disclosed |
| CN-110003244-A | Thiazole triazin compound and its application containing trifluoromethyl benzyl | 沈阳药科大学 | 2019-07-12 | — | — | CN | disclosed |
| CN-110003244-A | Thiazole triazin compound and its application containing trifluoromethyl benzyl | 沈阳药科大学 | 2019-07-12 | — | — | CN | disclosed |
| CN-103732065-B | For treating the benzofuran compound of infection with hepatitis C virus | 葛兰素集团有限公司 | 2016-10-26 | — | — | CN | disclosed |
| CN-104334535-B | Dendrimer-like aminoamides with sodium channel blocking activity for the treatment of dry eye and other mucosal diseases | 帕里昂科学公司 | 2016-10-05 | — | — | CN | disclosed |
| CN-105859598-A | Preparation method of polysubstituted dithioaryl imine derivative | 青岛科技大学 | 2016-08-17 | — | — | CN | disclosed |
| EP-3019483-A1 | THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE | Agios Pharmaceuticals, Inc. (US) | 2016-05-18 | — | — | EP | disclosed |
| EP-2970107-A1 | PHOTOSWITCHABLE HDAC INHIBITORS | The General Hospital Corporation (US) | 2016-01-20 | — | — | EP | disclosed |
| US-20150279654-A1 | TREATING SOLUTION FOR ELECTRONIC PARTS, AND PROCESS FOR PRODUCING ELECTRONIC PARTS | FINE POLYMERS CORPORATION (JP) | 2015-10-01 | — | — | US | disclosed |
| CN-104334535-A | Dendrimer-like aminoamides with sodium channel blocking activity for the treatment of dry eye and other mucosal diseases | PARION SCIENCES INC | 2015-02-04 | — | — | CN | disclosed |
| WO-2015003640-A1 | THERAPEUTICALLY ACTIVE COMPOUNDS AND THEIR METHODS OF USE | AGIOS PHARMACEUTICALS, INC. (US) | 2015-01-15 | — | — | WO | disclosed |
| WO-2014160221-A1 | PHOTOSWITCHABLE HDAC INHIBITORS | THE GENERAL HOSPITAL CORPORATION (US) | 2014-10-02 | — | — | WO | disclosed |
| CN-103732065-A | Benzofuran compounds for the treatment of hepatitis c virus infections | GLAXO GROUP LTD | 2014-04-16 | — | — | CN | disclosed |