Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 3/20 | 0.51 |
| ▸ | MMP12 | P39900 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.44 |
| ▸ | CYP21A2 | P08686 | 1/20 | 0.44 |
| ▸ | CHUK | O15111 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.42 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.41 |
| ▸ | RARB | P10826 | 1/20 | 0.41 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1286084 | 0.89 | HRH1 (0.53) | CYP17A1HRH1FFAR1HDAC2TBXAS1 | |
| SCHEMBL10769953 | 0.83 | HRH1 (0.57) | CYP17A1HRH1FFAR1TBXAS1FAAH | |
| SCHEMBL933474 | 0.82 | PRKCI (0.57) | CYP17A1CYP11B1CHUKROCK2CYP3A4 | |
| SCHEMBL6027 | 0.82 | MKNK1 (0.58) | TBXAS1 | |
| SCHEMBL31351850 | 0.81 | HRH1 (0.60) | HRH1HDAC2TBXAS1FAAHCES1 | |
| SCHEMBL11262500 | 0.81 | FFAR1 (0.63) | MMP12MMP13FFAR1HDAC2 | |
| SCHEMBL7369203 | 0.81 | HRH1 (0.60) | HRH1HDAC2TBXAS1FAAHCES1 | |
| SCHEMBL18248576 | 0.81 | HRH1 (0.60) | HRH1HDAC2TBXAS1FAAHCES1 | |
| SCHEMBL8813877 | 0.80 | MAOB (0.53) | FFAR1HDAC2 | |
| SCHEMBL28103661 | 0.79 | CYP17A1 (0.56) | CYP17A1MMP12MMP13CYP11B1CHUK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011006935-A2 | TETRAZOLE DERIVATIVES | MERCK SERONO S.A. (CH) | 2011-01-20 | — | — | WO | disclosed |