Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 7/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 6/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL2753831 | 0.81 | CYP1A1 (0.47) | CLK4MAPTKDM4EALDH1A1NPC1 | |
| SCHEMBL2097607 | 0.79 | SCN5A (0.41) | MAPTKDM4EALDH1A1NPC1RAB9A | |
| SCHEMBL17206220 | 0.79 | DYRK1A (0.57) | CLK4CYP19A1MAPTKDM4EALDH1A1 | |
| SCHEMBL2753514 | 0.79 | ALDH1A1 (0.45) | MAPTKDM4EALDH1A1HSD17B10RAB9A | |
| SCHEMBL9953126 | 0.79 | CYP2A6 (0.49) | CYP19A1 | |
| SCHEMBL2091591 | 0.76 | METAP2 (0.38) | — | |
| SCHEMBL5539715 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1NPC1RAB9AATM | |
| SCHEMBL1149164 | 0.76 | NOTUM (0.43) | CYP19A1MAPTKDM4EALDH1A1NPC1 | |
| SCHEMBL2752160 | 0.74 | CYP1A1 (0.55) | MAPTKDM4EALDH1A1TP53HSD17B10 | |
| SCHEMBL2751483 | 0.74 | CA12 (0.44) | MAPTKDM4EALDH1A1HSD17B10NPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0683772-A1 | RETROVIRAL PROTEASE INHIBITING COMPOUNDS | ABBOTT LABORATORIES (US) | 1995-11-29 | — | — | EP | disclosed |
| EP-0683772-A4 | RETROVIRAL PROTEASE INHIBITING COMPOUNDS. | ABBOTT LAB (US) | 1995-09-27 | — | — | EP | disclosed |
| US-5207816-A | Herbicides | BASF AKTIENGESELLSCHAFT (DE) | 1993-05-04 | — | — | US | disclosed |