Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8474502 | 0.91 | PTGS1 (0.33) | PTGS1PTGS2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL8477572 | 0.88 | KDM4E (0.30) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL8480055 | 0.83 | ESR1 (0.36) | PTGS2KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL8476637 | 0.80 | ITGB2 (0.33) | PTGS1PTGS2MAPT | |
| SCHEMBL8478779 | 0.79 | ALDH1A1 (0.32) | KDM4EALDH1A1MAPTHPGDHSD17B10 | |
| SCHEMBL8475633 | 0.74 | TDP1 (0.31) | ESR1ESR2TDP1 | |
| SCHEMBL8478501 | 0.72 | MAPT (0.37) | PTGS2KDM4EALDH1A1MAPTHPGD | |
| SCHEMBL8480800 | 0.72 | ACHE (0.35) | PTGS1PTGS2KDM4EALDH1A1CYP1A2 | |
| SCHEMBL8478609 | 0.70 | TP53 (0.34) | PTGS1PTGS2MAPTHPGDTDP1 | |
| SCHEMBL8477832 | 0.69 | TP53 (0.34) | PTGS1PTGS2KDM4EALDH1A1MAPT |
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-6004988-A | Carboxylic acid derivatives, their preparation and their use | BASF AKTIENGESELLSCHAFT (DE) | 1999-12-21 | — | — | US | disclosed |