Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | TACR1 | P25103 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CETP | P11597 | 2/20 | 0.32 |
| ▸ | SOS1 | Q07889 | 2/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.31 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | TDO2 | P48775 | 1/20 | 0.31 |
| ▸ | DPP4 | P27487 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4705055 | 0.84 | ALDH1A1 (0.34) | ALDH1A1TACR1HPGDSMN1; SMN2CNR2 | |
| SCHEMBL4705320 | 0.83 | SOS1 (0.34) | ALDH1A1TACR1HPGDSMN1; SMN2CNR2 | |
| SCHEMBL4706657 | 0.83 | ALDH1A1 (0.42) | ALDH1A1TACR1HPGDSMN1; SMN2CNR2 | |
| SCHEMBL4705321 | 0.82 | TACR1 (0.35) | ALDH1A1TACR1HPGDSMN1; SMN2TSHR | |
| SCHEMBL4708876 | 0.76 | GHSR (0.38) | ALDH1A1TACR1HPGDSMN1; SMN2TSHR | |
| Hydrochloric Acid SCHEMBL4708409 | 0.73 | LMNA (0.36) | TACR1HPGDSMN1; SMN2CETPTSHR | |
| SCHEMBL4705280 | 0.73 | PTGER4 (0.40) | TACR1 | |
| SCHEMBL4790291 | 0.73 | PTGER4 (0.40) | TACR1 | |
| SCHEMBL4707556 | 0.73 | RORB (0.39) | ALDH1A1SMN1; SMN2TSHRKDM4EPIK3CA | |
| SCHEMBL4706503 | 0.70 | P2RX7 (0.37) | ALDH1A1HPGDSMN1; SMN2TSHRMAPT |
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-1501809-B1 | TRIAZOLE DERIVATIVES AS TACHYKININ RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 2008-01-16 | — | — | EP | disclosed |