Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10530031 | 0.90 | CYP19A1 (0.47) | CYP19A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL10528223 | 0.81 | CYP19A1 (0.60) | CYP19A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL10527461 | 0.79 | CYP19A1 (0.58) | CYP19A1KDM4EMEN1KMT2AGAA | |
| SCHEMBL10529884 | 0.79 | HPGD (0.49) | KDM4EMEN1KMT2AGAASMN1; SMN2 | |
| SCHEMBL10527405 | 0.79 | CYP19A1 (0.65) | CYP19A1KDM4EMEN1KMT2ACYP2C19 | |
| SCHEMBL10525772 | 0.78 | KMT2A (0.53) | KDM4EMEN1KMT2AGAASMN1; SMN2 | |
| SCHEMBL6664414 | 0.74 | CYP1A2 (0.53) | KDM4EMEN1KMT2AGAASMN1; SMN2 | |
| SCHEMBL27884566 | 0.74 | CYP2C19 (0.50) | KDM4EMEN1KMT2AGAASMN1; SMN2 | |
| SCHEMBL9505466 | 0.74 | CYP19A1 (0.43) | CYP19A1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL13620028 | 0.74 | MEN1 (0.54) | KDM4EMEN1KMT2AGAASMN1; SMN2 |
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-4797411-A | ANTITUMOR AGENTS | FARMITALIA CARLO ERBA S.P.A. (IT) | 1989-01-10 | — | — | US | disclosed |
| EP-0253681-A2 | Cycloalkyl-substituted 4-pyridyl derivatives and process for their preparation | FARMITALIA CARLO ERBA S.r.l. (IT) | 1988-01-20 | — | — | EP | disclosed |