Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | NR1H4 | Q96RI1 | 2/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | PPIB | P23284 | 1/20 | 0.41 |
| ▸ | PPIA | P62937 | 1/20 | 0.41 |
| ▸ | PPID | Q08752 | 1/20 | 0.41 |
| ▸ | PPIG | Q13427 | 1/20 | 0.41 |
| ▸ | CARM1 | Q86X55 | 2/20 | 0.41 |
| ▸ | PRMT6 | Q96LA8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31314473 | 0.85 | TSHR (0.59) | TSHRCYP1A2CYP2C19TDP1MAPT | |
| SCHEMBL585949 | 0.83 | NR1H4 (0.58) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL12779074 | 0.82 | SMN1; SMN2 (0.62) | TSHRCYP1A2CYP2C19TDP1MAPT | |
| SCHEMBL16370233 | 0.82 | NPC1 (0.65) | MAPTHPGDSMN1; SMN2NPC1 | |
| SCHEMBL29278182 | 0.81 | MAPT (0.43) | TDP1MAPTNR1H4CASP1ALDH1A1 | |
| SCHEMBL16392318 | 0.81 | HDAC1 (0.47) | TSHRSMN1; SMN2 | |
| SCHEMBL1724603 | 0.81 | TSHR (0.50) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL2858938 | 0.81 | CYP2C9 (0.46) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL10732696 | 0.80 | NPC1 (0.49) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL5494631 | 0.79 | TSHR (0.41) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015004481-A1 | IMIDAZO-CONDENSED BICYCLES AS INHIBITORS OF DISCOIDIN DOMAIN RECEPTORS (DDRS) | ASTEX THERAPEUTICS LIMITED (GB) | 2015-01-15 | — | — | WO | disclosed |
| WO-2015004481-A1 | IMIDAZO-CONDENSED BICYCLES AS INHIBITORS OF DISCOIDIN DOMAIN RECEPTORS (DDRS) | ASTEX THERAPEUTICS LIMITED (GB) | 2015-01-15 | — | — | WO | disclosed |