Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARA | P10276 | 8/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | RXRA | P19793 | 10/20 | 0.33 |
| ▸ | RARB | P10826 | 7/20 | 0.33 |
| ▸ | RARG | P13631 | 7/20 | 0.33 |
| ▸ | RXRB | P28702 | 4/20 | 0.33 |
| ▸ | RXRG | P48443 | 4/20 | 0.33 |
| ▸ | HNF4A | P41235 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6725577 | 0.89 | RARA (0.32) | RARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9037686 | 0.87 | RXRA (0.35) | RARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL6726207 | 0.86 | RXRA (0.35) | RARARXRARARBRARGRXRB | |
| SCHEMBL7828888 | 0.78 | RXRA (0.35) | RARARXRARARBRARGRXRB | |
| SCHEMBL6721524 | 0.78 | RXRA (0.35) | RARACYP3A4CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL6726076 | 0.76 | PTGS1 (0.32) | RARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL8346248 | 0.72 | HPGD (0.33) | MEN1KMT2ANOTUM | |
| SCHEMBL6721354 | 0.72 | RXRA (0.33) | RARACYP3A4CYP1A2CYP2D6CYP2C9 | |
| SCHEMBL7617142 | 0.71 | RXRA (0.39) | RARACYP3A4RXRARARBRARG | |
| SCHEMBL6721464 | 0.71 | KDM4E (0.35) | RARACYP3A4CYP1A2CYP2C9RXRA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0712853-A1 | PYRAZOLE DERIVATIVE | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1996-05-22 | — | — | EP | disclosed |