Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.43 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28272496 | 0.88 | ALDH1A1 (0.49) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL5529302 | 0.87 | NPC1 (0.47) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL8088061 | 0.87 | ALDH1A1 (0.45) | ALDH1A1ESR1ESR2LMNAALOX15 | |
| SCHEMBL8090978 | 0.86 | ALDH1A1 (0.46) | ALDH1A1ESR1ESR2LMNAALOX15 | |
| SCHEMBL51339 | 0.81 | ESR1 (0.69) | ALDH1A1ESR1ESR2CA2 | |
| SCHEMBL3805385 | 0.78 | MIF (0.58) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL8079775 | 0.77 | ALDH1A1 (0.49) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL14433010 | 0.76 | MMP9 (0.42) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL4878584 | 0.76 | ALDH1A1 (0.49) | ALDH1A1LMNAALOX15APEX1MAPK1 | |
| SCHEMBL28609252 | 0.76 | AOC3 (0.56) | ALDH1A1LMNAALOX15APEX1MAPK1 |
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 2 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 |
| US-6004988-A | Carboxylic acid derivatives, their preparation and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-12-21 | — | — | US | disclosed |