Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA3 | P07451 | 1/20 | 0.38 |
| ▸ | TYR | P14679 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| SCHEMBL9018820 | 0.91 | HTT (0.55) | HTTTSHRTP53ALOX15SRD5A2 | |
| SCHEMBL8484086 | 0.84 | HPGD (0.50) | HTTCYP2C9CYP2C19HSD17B10SMN1; SMN2 | |
| SCHEMBL8487539 | 0.83 | CYP2C9 (0.33) | HTTCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL8488661 | 0.82 | IDO1 (0.39) | CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL22594594 | 0.79 | TSHR (0.52) | HTTTSHRTP53ALOX15SRD5A2 | |
| SCHEMBL40593 | 0.78 | TSHR (0.71) | TSHRTP53ALOX15SRD5A2CA1 | |
| SCHEMBL8485183 | 0.77 | NR1H2 (0.41) | TSHRALOX15CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL6513037 | 0.76 | TSHR (0.67) | TSHRTP53ALOX15SRD5A2CA1 | |
| SCHEMBL31427160 | 0.76 | TSHR (0.67) | TSHRTP53ALOX15SRD5A2CA1 | |
| SCHEMBL5511182 | 0.76 | TSHR (0.67) | TSHRTP53ALOX15SRD5A2CA1 |
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-5932731-A | HYDROLYZING A HETEROAROMATIC HALOGENATED METHYL SULFIDE IN PRESENCE OF AN ACID | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1999-08-03 | — | — | US | disclosed |