Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHBP | P24387 | 2/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 3/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA9 | Q16790 | 3/20 | 0.47 |
| ▸ | CTSK | P43235 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | ANPEP | P15144 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.42 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.42 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7587026 | 0.82 | CA12 (0.46) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL7587021 | 0.82 | CA12 (0.46) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL7539011 | 0.78 | HDAC3 (0.39) | CA12CA1CA2CA9ANPEP | |
| SCHEMBL7539014 | 0.78 | HDAC3 (0.39) | CA12CA1CA2CA9ANPEP | |
| SCHEMBL7539441 | 0.78 | CASP3 (0.54) | CRHBPCRHR2CTSKCTSSALDH1A1 | |
| SCHEMBL7541870 | 0.76 | FOLH1 (0.54) | — | |
| SCHEMBL7538785 | 0.76 | FOLH1 (0.54) | — | |
| SCHEMBL27564140 | 0.75 | FPR2 (0.46) | CRHBPCRHR2CTSKCTSSALDH1A1 | |
| SCHEMBL7544683 | 0.74 | MAPT (0.45) | CTSKCTSSMAPK1ALDH1A1RAB9A | |
| SCHEMBL7544065 | 0.74 | ITGB1 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1376143-A | Carboxylic acid derivatives and adhesion molecule inhibitors containing the same as the active ingredient | TORAY INDUSTRIES (JP) | 2002-10-23 | — | — | CN | disclosed |