Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | PARP1 | P09874 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GRM5 | P41594 | 2/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.45 |
| ▸ | FEN1 | P39748 | 1/20 | 0.45 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.45 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.44 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.43 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.43 |
| ▸ | GRM3 | Q14832 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL16506712 | 1.00 | KMO (0.64) | KMOGAAPARP1ALDH1A1GRM5 | |
| SCHEMBL16506371 | 0.82 | KMO (0.62) | KMOSMN1; SMN2DGAT1 | |
| SCHEMBL11363746 | 0.80 | KMO (0.55) | KMOPARP1ALDH1A1NPSR1SMN1; SMN2 | |
| SCHEMBL11363742 | 0.80 | KMO (0.55) | KMOPARP1ALDH1A1NPSR1SMN1; SMN2 | |
| SCHEMBL8008096 | 0.80 | KMO (0.55) | KMOPARP1ALDH1A1GRM5SMN1; SMN2 | |
| SCHEMBL8008104 | 0.80 | KMO (0.55) | KMOGAAPARP1ALDH1A1SMN1; SMN2 | |
| SCHEMBL8775309 | 0.80 | KMO (0.58) | KMOPARP1ALDH1A1PARP10DGAT1 | |
| SCHEMBL11374054 | 0.80 | KMO (0.58) | KMOPARP1ALDH1A1PARP10DGAT1 | |
| SCHEMBL16521477 | 0.80 | KMO (0.58) | KMOPARP1ALDH1A1PARP10DGAT1 | |
| SCHEMBL8018811 | 0.79 | NPSR1 (0.43) | KMOGAAPARP1ALDH1A1GRM5 |
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-0973720-A1 | 2-SUBSTITUTED BENZOYL-CYCLOALKYL-1-CARBOXYLIC ACID DERIVATIVES | PHARMACIA & UPJOHN S.p.A. (IT) | 2000-01-26 | — | — | EP | disclosed |
| WO-1998040344-A1 | 2-SUBSTITUTED BENZOYL-CYCLOALKYL-1-CARBOXYLIC ACID DERIVATIVES | PHARMACIA & UPJOHN S.P.A. (IT) | 1998-09-17 | — | — | WO | disclosed |