Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR4 | O95977 | 1/20 | 0.39 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.37 |
| ▸ | ITGAV | P06756 | 2/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.36 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.36 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7317232 | 0.84 | CA1 (0.38) | HDAC1LTA4HCA1CA2 | |
| SCHEMBL11435630 | 0.81 | ITGB3 (0.42) | LTA4HHPGDKDM4ESMN1; SMN2ITGB3 | |
| SCHEMBL27889226 | 0.81 | EGFR (0.49) | FFAR1S1PR1 | |
| SCHEMBL7308299 | 0.81 | CTSK (0.41) | HDAC1LTA4HALDH1A1FFAR1MEN1 | |
| SCHEMBL7311698 | 0.77 | HDAC1 (0.44) | S1PR5HDAC1LTA4HS1PR1S1PR3 | |
| SCHEMBL28474465 | 0.76 | KDM4E (0.51) | HPGDKDM4EALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL20957060 | 0.74 | CYP1A2 (0.47) | HDAC1HPGDKDM4EALDH1A1KMT2A | |
| SCHEMBL27475204 | 0.73 | CYP3A4 (0.39) | HPGDKDM4EALDH1A1ITGB3ITGAV | |
| SCHEMBL7315180 | 0.72 | ESR1 (0.39) | HPGDKDM4EALDH1A1ITGB3ITGAV | |
| SCHEMBL10581584 | 0.72 | CD44 (0.45) | HPGDKDM4EALDH1A1 |
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-RE31617-E | ANTICOAGULANTS; HYPOTENSIVE AND BRONCHODILATOR AGENTS | BRISTOL-MYERS COMPANY (US) | 1984-06-26 | — | — | US | disclosed |
| US-3932407-A | BRONCHODILATORS, HYPOTENSIVE AGENTS, ANTICOAGULANTS | BRISTOL-MYERS COMPANY (US) | 1976-01-13 | — | — | US | disclosed |