Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | KIF11 | P52732 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.43 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | LDHA | P00338 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28271027 | 0.85 | NPC1 (0.49) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL8631216 | 0.81 | HSD17B10 (0.46) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL890797 | 0.80 | ESR1 (0.57) | ALDH1A1LMNAHSD17B10CA2CYP1A2 | |
| SCHEMBL1972152 | 0.80 | MEN1 (0.49) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL14685859 | 0.80 | PDE4B (0.51) | ALDH1A1LMNAKIF11HDAC3HDAC1 | |
| SCHEMBL1614867 | 0.80 | CYP2C19 (0.54) | LMNAHSD17B10CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4878584 | 0.79 | ALDH1A1 (0.49) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL11994174 | 0.79 | KCNN4 (0.41) | ALDH1A1LMNAAPEX1MAPK1HSD17B10 | |
| SCHEMBL3826995 | 0.79 | ELANE (0.53) | LMNAHSD17B10TDP1CA2MAPT | |
| Hydrochloric Acid SCHEMBL2861649 | 0.78 | CYP2C19 (0.55) | ALDH1A1LMNAHSD17B10CYP1A2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0862550-B1 | CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE | BASF AG (DE) | 2000-11-08 | — | — | EP | disclosed |
| EP-0862550-A1 | CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE | BASF AKTIENGESELLSCHAFT (DE) | 1998-09-09 | — | — | EP | disclosed |
| WO-1997009294-A1 | CARBOXYLIC ACID DERIVATIVES, THEIR PREPARATION AND THEIR USE | BASF AKTIENGESELLSCHAFT (DE) | 1997-03-13 | — | — | WO | disclosed |