Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RORC | P51449 | 11/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18212236 | 0.68 | RORC (0.74) | RORCCA12CA1CA2CA9 | |
| Benzoic Acid SCHEMBL1434863 | 0.65 | TSHR (0.70) | CYP2C9CYP2C8SRD5A2TDP1 | |
| Benzoic Acid SCHEMBL9644655 | 0.65 | TSHR (0.70) | CYP2C9CYP2C8SRD5A2TDP1 | |
| Benzoic Acid SCHEMBL4158962 | 0.65 | TSHR (0.70) | CYP2C9CYP2C8SRD5A2TDP1 | |
| SCHEMBL28673795 | 0.64 | BCL2 (0.50) | CYP2C9CYP2C8CYP1A2CYP3A4CYP2C19 | |
| Benzoic Acid SCHEMBL11340972 | 0.63 | TSHR (0.67) | CYP2C9CYP2C8SRD5A2TDP1 | |
| Benzoic Acid SCHEMBL21145058 | 0.63 | TSHR (0.67) | CYP2C9CYP2C8SRD5A2TDP1 | |
| Benzoic Acid SCHEMBL15300262 | 0.63 | TSHR (0.74) | CYP2C9CYP2C8SRD5A2TDP1 | |
| SCHEMBL9496987 | 0.62 | AKR1C3 (0.52) | SRD5A2POLBTDP1L3MBTL1 | |
| SCHEMBL9497002 | 0.62 | AKR1C3 (0.52) | SRD5A2POLBTDP1L3MBTL1 |
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-3080090-B1 | BICYCLIC HETEROARYL INDOLE ANALOGUES USEFUL AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS SA (CH) | 2018-01-31 | — | — | EP | disclosed |