Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10527461 | 0.94 | CYP19A1 (0.58) | CYP1A2CYP3A4CYP19A1MEN1KMT2A | |
| SCHEMBL10528223 | 0.93 | CYP19A1 (0.60) | CYP1A2CYP3A4CYP19A1MEN1KMT2A | |
| SCHEMBL2184519 | 0.80 | SMN1; SMN2 (0.64) | CYP1A2CYP3A4MEN1KMT2AGAA | |
| SCHEMBL1028262 | 0.79 | CYP1A2 (0.57) | CYP1A2CYP3A4MEN1KMT2AGAA | |
| SCHEMBL10530031 | 0.75 | CYP19A1 (0.47) | CYP1A2CYP3A4CYP19A1MEN1KMT2A | |
| SCHEMBL14660006 | 0.75 | CYP1A2 (0.53) | CYP1A2CYP3A4MEN1KMT2AGAA | |
| SCHEMBL27536605 | 0.75 | CYP1A2 (0.64) | CYP1A2CYP3A4MEN1KMT2AGAA | |
| SCHEMBL3289319 | 0.73 | CYP3A4 (0.62) | CYP1A2CYP3A4MEN1KMT2AGAA | |
| SCHEMBL933349 | 0.73 | CYP3A4 (0.62) | CYP1A2CYP3A4MEN1KMT2AGAA | |
| SCHEMBL6264784 | 0.73 | CYP3A4 (0.62) | CYP1A2CYP3A4MEN1KMT2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-4797411-A | ANTITUMOR AGENTS | FARMITALIA CARLO ERBA S.P.A. (IT) | 1989-01-10 | — | — | US | disclosed |