Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 4/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | MAOB | P27338 | 4/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11662762 | 0.83 | TRPA1 (0.36) | TAAR1IDO1ESR1 | |
| SCHEMBL11662934 | 0.79 | SLC6A2 (0.45) | TAAR1ALDH1A1 | |
| SCHEMBL9274712 | 0.76 | TAAR1 (0.47) | TAAR1PYCR1IDO1ESR1ESR2 | |
| SCHEMBL11514383 | 0.72 | TAAR1 (0.40) | TAAR1PYCR1IDO1ESR1ESR2 | |
| SCHEMBL11663130 | 0.72 | IDO1 (0.41) | IDO1MAOBALDH1A1 | |
| SCHEMBL1691810 | 0.72 | ESR1 (0.54) | TAAR1PYCR1IDO1ESR1ESR2 | |
| SCHEMBL11662292 | 0.71 | TRPA1 (0.35) | IDO1ESR1 | |
| SCHEMBL25218246 | 0.69 | KMT2A (0.44) | TAAR1PYCR1IDO1ESR1ESR2 | |
| SCHEMBL11665884 | 0.69 | SLC6A2 (0.42) | TAAR1ALDH1A1 | |
| SCHEMBL11660500 | 0.69 | HTR2A (0.45) | TAAR1IDO1MAOBALDH1A1 |
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-4099014-A | BLOOD PLATELET AGGREGATION INHIBITORS | THE UPJOHN COMPANY (US) | 1978-07-04 | — | — | US | disclosed |