Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.47 |
| ▸ | TACR1 | P25103 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29953843 | 0.72 | ENPP2 (0.35) | — | |
| SCHEMBL791863 | 0.69 | IDO1 (0.58) | IDO1TACR1TSHR | |
| SCHEMBL7264258 | 0.67 | IDO1 (0.50) | IDO1TACR1TSHR | |
| SCHEMBL12300325 | 0.66 | IDO1 (0.54) | IDO1TACR1TSHR | |
| SCHEMBL2095571 | 0.64 | IDO1 (0.58) | IDO1TACR1TSHR | |
| SCHEMBL19408165 | 0.64 | IDO1 (0.58) | IDO1TACR1TSHR | |
| SCHEMBL8255130 | 0.64 | SLC6A2 (0.43) | IDO1TSHR | |
| SCHEMBL1520698 | 0.64 | IDO1 (1.00) | IDO1TACR1 | |
| SCHEMBL14241798 | 0.64 | IDO1 (0.52) | IDO1TACR1TSHR | |
| SCHEMBL17069262 | 0.64 | IDO1 (0.52) | IDO1TACR1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0304221-B1 | 5-amino or substituted amino 1,2,3-triazoles useful as antiproliferative agents | MERCK & CO INC (US) | 1994-02-16 | — | — | EP | disclosed |
| US-5045543-A | Treatment of cancer with high probability of metastasis | MERCK & CO., INC. (US) | 1991-09-03 | — | — | US | disclosed |
| US-4847257-A | PSORIASIS | MERCK & CO., INC. (US) | 1989-07-11 | — | — | US | disclosed |