Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 8/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PRCP | P42785 | 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 | |
|---|---|---|---|---|
| SCHEMBL7783271 | 0.98 | MAOB (0.39) | MAOBTAAR1TP53IDO1SLC6A3 | |
| SCHEMBL7782593 | 0.92 | IDO1 (0.42) | MAOBTAAR1IDO1SLC6A3CYP3A4 | |
| SCHEMBL7865721 | 0.85 | TAAR1 (0.45) | MAOBTAAR1CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL7846359 | 0.81 | TP53 (0.43) | TP53SLC6A3PRCP | |
| SCHEMBL7782591 | 0.79 | ADRB2 (0.42) | TP53IDO1SLC6A3 | |
| Ammonia Solution, Strong SCHEMBL7569458 | 0.79 | IDO1 (0.40) | IDO1SLC6A3CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL27220940 | 0.73 | TAAR1 (0.50) | MAOBTAAR1 | |
| SCHEMBL27687280 | 0.73 | IDO1 (0.62) | MAOBTAAR1IDO1 | |
| SCHEMBL7846364 | 0.72 | MCL1 (0.35) | TP53IDO1SLC6A3CYP3A4CYP2D6 | |
| SCHEMBL21153574 | 0.72 | KIF11 (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1137647-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2001-10-04 | — | — | EP | disclosed |
| WO-2000034268-A1 | THIOUREA INHIBITORS OF HERPES VIRUSES | AMERICAN HOME PRODUCTS CORPORATION (US) | 2000-06-15 | — | — | WO | disclosed |