Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11731324 | 0.89 | TBXAS1 (0.41) | ALDH1A1MAPK1KMT2ATDP1TBXAS1 | |
| SCHEMBL11729091 | 0.88 | TBXA2R (0.39) | TBXAS1 | |
| SCHEMBL11730758 | 0.86 | TDP1 (0.45) | ALDH1A1MAPK1KMT2ATDP1 | |
| SCHEMBL11852601 | 0.85 | ALOX15 (0.40) | ALDH1A1TBXAS1 | |
| SCHEMBL11726052 | 0.84 | FAAH (0.40) | ALDH1A1MAPK1KMT2ATDP1 | |
| SCHEMBL11730979 | 0.82 | HPGD (0.44) | ALDH1A1MAPK1KMT2ATDP1 | |
| SCHEMBL11722951 | 0.82 | TSHR (0.46) | ALDH1A1MAPK1TDP1 | |
| SCHEMBL11730056 | 0.81 | ALDH1A1 (0.41) | ALDH1A1MAPK1KMT2ATDP1 | |
| SCHEMBL11732457 | 0.81 | ALDH1A1 (0.39) | ALDH1A1MAPK1KMT2ATDP1 | |
| SCHEMBL11730168 | 0.81 | TBXA2R (0.46) | ALDH1A1MAPK1KMT2ATDP1 |
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-4055596-A | PHARMACEUTICALS | MERCK & CO., INC. (US) | 1977-10-25 | — | — | US | disclosed |
| US-3991106-A | FOR ESTRUS SYNCHRONIZATION AND TREATMENT OF INFERTILITY | MERCK & CO., INC. (US) | 1976-11-09 | — | — | US | disclosed |