Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.52 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.51 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.51 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.51 |
| ▸ | THPO | P40225 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28012269 | 0.89 | ALDH1A1 (0.57) | SMN1; SMN2ALDH1A1POLBKEAP1KDM4E | |
| SCHEMBL11466281 | 0.83 | ALDH1A1 (0.54) | SMN1; SMN2ALDH1A1POLBKEAP1HPGD | |
| SCHEMBL8867745 | 0.83 | ALDH1A1 (0.54) | SMN1; SMN2ALDH1A1POLBKEAP1HPGD | |
| SCHEMBL8867750 | 0.83 | ALDH1A1 (0.54) | SMN1; SMN2ALDH1A1POLBKEAP1HPGD | |
| SCHEMBL1345370 | 0.81 | LMNA (0.56) | SMN1; SMN2ALDH1A1KEAP1PTGS1CXCR1 | |
| SCHEMBL729868 | 0.81 | PTGS1 (0.56) | SMN1; SMN2ALDH1A1PTGS1MAPTCXCR1 | |
| SCHEMBL245468 | 0.81 | MEN1 (0.60) | SMN1; SMN2ALDH1A1POLBKEAP1KDM4E | |
| SCHEMBL15456905 | 0.81 | LMNA (0.56) | SMN1; SMN2ALDH1A1KEAP1PTGS1CXCR1 | |
| SCHEMBL1345262 | 0.81 | LMNA (0.56) | SMN1; SMN2ALDH1A1KEAP1PTGS1CXCR1 | |
| SCHEMBL10100499 | 0.81 | KEAP1 (0.55) | SMN1; SMN2ALDH1A1POLBKEAP1KDM4E |
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-6972296-B2 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | ENCYSIVE PHARMACEUTICALS INC. (US) | 2005-12-06 | — | — | US | disclosed |