Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.38 |
| ▸ | CACNB4 | O00305 | 2/20 | 0.38 |
| ▸ | CACNA1A | O00555 | 2/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.38 |
| ▸ | CACNG3 | O60359 | 2/20 | 0.38 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.38 |
| ▸ | CACNB3 | P54284 | 2/20 | 0.38 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.38 |
| ▸ | CACNG7 | P62955 | 2/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.38 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.38 |
| ▸ | CACNB1 | Q02641 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL117727 | 0.86 | CACNB4 (0.40) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL10712953 | 0.83 | IDO1 (0.35) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL10711888 | 0.82 | BRD4 (0.40) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL11097244 | 0.81 | CACNA1B (0.37) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL10711944 | 0.81 | CREBBP (0.46) | KDM4ESTK10SLKGSK3BCREBBP | |
| SCHEMBL10713399 | 0.81 | PGR (0.36) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL11093677 | 0.80 | CACNB4 (0.36) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL10711636 | 0.79 | CES1 (0.36) | ALDH1A1MAPTCACNB4CACNA1ACACNA1G | |
| SCHEMBL10712554 | 0.79 | KMT2A (0.45) | ALDH1A1HPGDMAPTCYP1A2CYP2C9 | |
| SCHEMBL10714048 | 0.77 | ALDH1A1 (0.36) | ALDH1A1HPGDMAPTCYP1A2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4670566-A | ANTIIFLAMMATORY AGENTS, ANTICOAGULANTS | A. H. ROBINS COMPANY, INCORPORATED (US) | 1987-06-02 | — | — | US | disclosed |
| US-4440785-A | Methods of using 2-aminobiphenylacetic acids, esters, and metal salts thereof to treat inflammation | A. H. ROBINS COMPANY, INC. (US) | 1984-04-03 | — | — | US | disclosed |