Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HNF4A | P41235 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MITF | O75030 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TTR | P02766 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL2314302 | 0.92 | ALDH1A1 (0.52) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL4355034 | 0.82 | ALDH1A1 (0.46) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL2310226 | 0.80 | HSP90AA1 (0.49) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| Triphenylene SCHEMBL6046853 | 0.78 | TDP1 (0.45) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL1074424 | 0.77 | KDM4E (0.41) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL2311447 | 0.76 | HPRT1 (0.50) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL2312437 | 0.76 | HPRT1 (0.50) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL1931554 | 0.75 | ALDH1A1 (0.44) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL240651 | 0.75 | HTR2A (0.56) | ALDH1A1TSHRHTTTDP1HSD17B10 | |
| SCHEMBL2309762 | 0.74 | ALDH1A1 (0.40) | ALDH1A1TSHRHTTTDP1HSD17B10 |
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-4707476-A | TRANQUILIZERS | CIBA-GEIGY CORPORATION (US) | 1987-11-17 | — | — | US | disclosed |