Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 6/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TLR2 | O60603 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9084136 | 0.92 | ALDH1A1 (0.54) | ALDH1A1KDM4EUSP2HPGDCYP2C19 | |
| SCHEMBL16190215 | 0.82 | ALDH1A1 (0.53) | ALDH1A1KDM4EUSP2HPGDCYP2C19 | |
| SCHEMBL4553089 | 0.82 | PTGS2 (0.67) | ALDH1A1KDM4EHPGDHSD17B10PTGS2 | |
| SCHEMBL5943436 | 0.82 | ALDH1A1 (0.60) | ALDH1A1KDM4EUSP2HPGDCYP2C19 | |
| SCHEMBL15215870 | 0.80 | ALDH1A1 (0.50) | ALDH1A1KDM4EUSP2HPGDCYP2C19 | |
| SCHEMBL13142986 | 0.78 | ALDH1A1 (0.57) | ALDH1A1KDM4EUSP2HPGDCYP2C19 | |
| SCHEMBL4421848 | 0.76 | KMT2A (0.45) | HPGDCYP2C19HSD17B10PTGS2NPC1 | |
| SCHEMBL9083520 | 0.75 | TP53 (0.47) | ALDH1A1KDM4EHPGDCYP2C19HSD17B10 | |
| SCHEMBL9085187 | 0.74 | PTGS2 (0.41) | ALDH1A1KDM4EUSP2HPGDCYP2C19 | |
| SCHEMBL5943431 | 0.74 | ALDH1A1 (0.47) | ALDH1A1KDM4EUSP2HPGDCYP2C19 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5589490-A | BENZAMIDE DERIVATIVES WITH NITROXY ALKYL GROUPS | ITALFARMACO S.P.A. (IT) | 1996-12-31 | — | — | US | disclosed |
| EP-0540544-B1 | BENZOIC ACID SUBSTITUTED DERIVATIVES HAVING CARDIOVASCULAR ACTIVITY | ITALFARMACO SPA (IT) | 1995-02-15 | — | — | EP | disclosed |
| US-5366992-A | IN MIXTURE WITH AN EXCIPIENT | ITALFARMACO S.P.A. (IT) | 1994-11-22 | — | — | US | disclosed |
| WO-1992001668-A1 | BENZOIC ACID SUBSTITUTED DERIVATIVES HAVING CARDIOVASCULAR ACTIVITY | ITALFARMACO S.P.A. (IT) | 1992-02-06 | — | — | WO | disclosed |