Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | GRIN2D | O15399 | 4/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 4/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 4/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 4/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 4/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.31 |
| ▸ | COMT | P21964 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | VEGFA | P15692 | 1/20 | 0.30 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL626732 | 0.72 | GRIN2D (0.35) | ALDH1A1TSHRTDP1GRIN2DGRIN3B | |
| SCHEMBL6485501 | 0.72 | ALDH1A1 (0.36) | ALDH1A1TSHRTDP1GRIN2DGRIN3B | |
| SCHEMBL31711442 | 0.69 | GRIN2D (0.47) | ALDH1A1CYP1A2TSHRTDP1GRIN2D | |
| SCHEMBL10924079 | 0.68 | NPSR1 (0.40) | ALDH1A1TSHRTDP1GRIN2DGRIN3B | |
| SCHEMBL450176 | 0.68 | ALDH1A1 (0.51) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL38662525 | 0.67 | TSHR (0.53) | ALDH1A1TSHRTDP1GRIN2DGRIN3B | |
| SCHEMBL9847875 | 0.67 | ALDH1A1 (0.44) | ALDH1A1TSHRTDP1GRIN2DGRIN3B | |
| SCHEMBL1675773 | 0.67 | TSHR (0.42) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL496340 | 0.67 | GPR35 (0.40) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR | |
| SCHEMBL8482488 | 0.67 | TSHR (0.46) | ALDH1A1CYP1A2CYP2D6CYP2C19TSHR |
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-0610384-B1 | PROCESS FOR THE PREPARATION OF FLUORINATED BENZOIC ACIDS | ABBOTT LAB (US) | 1997-09-03 | — | — | EP | disclosed |