Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM8 | Q7Z2W7 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5234966 | 1.00 | TRPM8 (0.32) | TRPM8KDM4EALDH1A1HDAC6ALK | |
| SCHEMBL5236173 | 0.93 | CYP17A1 (0.30) | CYP3A4 | |
| SCHEMBL5234567 | 0.93 | NR1H4 (0.35) | KDM4EALDH1A1GLAHPGDLMNA | |
| SCHEMBL5233446 | 0.92 | NPC1 (0.35) | KDM4EALDH1A1GLA | |
| SCHEMBL5233102 | 0.90 | TDP1 (0.34) | KDM4EALDH1A1 | |
| SCHEMBL5231429 | 0.90 | — | — | |
| SCHEMBL5238208 | 0.90 | ALDH1A1 (0.38) | TRPM8KDM4EALDH1A1HPGDLMNA | |
| SCHEMBL5233878 | 0.89 | — | — | |
| SCHEMBL5234535 | 0.89 | — | — | |
| SCHEMBL5235062 | 0.89 | TBK1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1622567-B1 | ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF | MERCK SHARP & DOHME (US) | 2013-07-24 | — | — | EP | claimed |
| EP-1439841-B1 | ANDROGEN RECEPTOR MODULATORS AND METHODS OF USE THEREOF | MERCK & CO INC (US) | 2007-09-19 | — | — | EP | claimed |