Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 9/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.50 |
| ▸ | MAPT | P10636 | 7/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 8/20 | 0.46 |
| ▸ | RAB9A | P51151 | 8/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | TP53 | P04637 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | CASP1 | P29466 | 2/20 | 0.46 |
| ▸ | CASP7 | P55210 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19597819 | 0.81 | MAPT (0.43) | KMT2AALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL27840250 | 0.81 | KMT2A (0.47) | KMT2AALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL10133307 | 0.78 | NPC1 (0.61) | KMT2AALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL18789747 | 0.78 | MEN1 (0.50) | KMT2AALDH1A1MAPTNPC1CASP1 | |
| SCHEMBL27805824 | 0.78 | ALDH1A1 (0.39) | KMT2AALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28067551 | 0.77 | ALDH1A1 (0.38) | KMT2AALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL28173261 | 0.77 | MEN1 (0.49) | KMT2AALDH1A1MAPTNPC1CASP1 | |
| SCHEMBL28152084 | 0.77 | NPC1 (0.59) | KMT2AALDH1A1KDM4EMAPTSMN1; SMN2 | |
| SCHEMBL6203397 | 0.75 | NR4A2 (0.51) | KMT2AMAPTMEN1 | |
| SCHEMBL6579243 | 0.74 | MAPT (0.45) | KMT2AALDH1A1MAPTNPC1RAB9A |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107108534-A | Probes for Imaging Huntingtin | CHDI基金会股份有限公司 | 2017-08-29 | — | — | CN | claimed |
| CN-107001345-A | Hete rocyclic derivatives and application thereof | 株式会社C&C新药研究所 | 2017-08-01 | — | — | CN | claimed |
| CN-101616919-B | Poly (ADP ribose) polymerase inhibitors | ABBOTT LAB | 2012-10-10 | — | — | CN | claimed |
| CN-104788430-B | The treatment method of pyrazole derivatives calcium release activation calcium channel modulators and non-small cell lung cancer | 理森制药股份公司 | 2019-10-22 | — | — | CN | disclosed |
| CN-106458934-B | Quinoxaline compounds and application thereof | 米伦纽姆医药公司 | 2019-08-16 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-109310690-A | Isoquinolin -3- base benzamide type and its preparation and its purposes | 萨穆梅德有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-108794411-A | Certain chemical entities, composition and method | 润新生物公司 | 2018-11-13 | — | — | CN | disclosed |
| CN-104080455-B | Certain chemical entities, compositions, and methods | 润新生物公司 | 2018-07-31 | — | — | CN | disclosed |
| CN-107245056-A | Chemical entities, composition and method | 润新生物公司 | 2017-10-13 | — | — | CN | disclosed |
| CN-107108534-A | Probes for Imaging Huntingtin | CHDI基金会股份有限公司 | 2017-08-29 | — | — | CN | disclosed |
| CN-107001345-A | Hete rocyclic derivatives and application thereof | 株式会社C&C新药研究所 | 2017-08-01 | — | — | CN | disclosed |
| CN-104053442-B | Certain chemical entities, compositions, and methods | 润新生物公司 | 2017-06-23 | — | — | CN | disclosed |
| CN-106458934-A | Quinoxaline compounds and uses thereof | 米伦纽姆医药公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-101616919-B | Poly (ADP ribose) polymerase inhibitors | ABBOTT LAB | 2012-10-10 | — | — | CN | disclosed |
| CN-102036561-A | Protein kinase modulators | CYLENE PHARMACEUTICALS INC | 2011-04-27 | — | — | CN | disclosed |
| CN-101616919-A | Poly (ADP ribose) polymerase inhibitors | ABBOTT LAB | 2009-12-30 | — | — | CN | disclosed |