Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 1/20 | 0.70 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.70 |
| ▸ | RAB9A | P51151 | 4/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.59 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.59 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | JUN | P05412 | 1/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.56 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.49 |
| ▸ | VCP | P55072 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11067983 | 1.00 | CYP11B1 (0.70) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL9605429 | 1.00 | CYP11B1 (0.70) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL29419007 | 0.89 | CYP11B1 (0.86) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL28356916 | 0.86 | MAPT (0.81) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL29691639 | 0.85 | CYP11B1 (0.86) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL29691623 | 0.85 | CYP11B1 (0.86) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL31668803 | 0.83 | CYP11B2 (1.00) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL9268248 | 0.83 | CYP11B2 (1.00) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL5496395 | 0.83 | CYP11B2 (1.00) | CYP11B1CYP11B2RAB9AKMT2AMAPT | |
| SCHEMBL29691532 | 0.83 | CYP11B1 (0.82) | CYP11B1CYP11B2RAB9AKMT2AMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4490531-A | THROMBOXAN INHIBITOR, ANTITUMOR AGENT, HYPOTENSIVE AGENT | THE UPJOHN COMPANY (US) | 1984-12-25 | — | — | US | disclosed |
| EP-0069521-A2 | Pyridinyl and imidazolyl derivatives of benzofurans and benzothiophenes | THE UPJOHN COMPANY (US) | 1983-01-12 | — | — | EP | disclosed |