Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | AVPR2 | P30518 | 12/20 | 0.32 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.32 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.32 |
| ▸ | ITGAL | P20701 | 1/20 | 0.32 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.32 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.32 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.32 |
| ▸ | IARS2 | Q9NSE4 | 1/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.31 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5377463 | 1.00 | SLC6A2 (0.35) | SLC6A2CNR2KDM4EALDH1A1HPGD | |
| SCHEMBL5395013 | 1.00 | SLC6A2 (0.35) | SLC6A2CNR2KDM4EALDH1A1HPGD | |
| SCHEMBL5395019 | 1.00 | SLC6A2 (0.35) | SLC6A2CNR2KDM4EALDH1A1HPGD | |
| SCHEMBL3807603 | 0.78 | AVPR2 (0.51) | KDM4EALDH1A1AVPR2AVPR1ACYP3A4 | |
| SCHEMBL3807598 | 0.78 | AVPR2 (0.51) | KDM4EALDH1A1AVPR2AVPR1ACYP3A4 | |
| SCHEMBL3557117 | 0.76 | AVPR2 (0.35) | KDM4EALDH1A1HPGDAVPR2AVPR1A | |
| SCHEMBL3557118 | 0.76 | AVPR2 (0.35) | KDM4EALDH1A1HPGDAVPR2AVPR1A | |
| SCHEMBL7680383 | 0.76 | CYP2C19 (0.45) | KDM4EALDH1A1HPGDCYP3A4CYP2C19 | |
| SCHEMBL14590035 | 0.75 | TGM2 (0.44) | KDM4EALDH1A1AVPR2AVPR1A | |
| SCHEMBL14590031 | 0.75 | ALDH1A1 (0.34) | KDM4EALDH1A1HPGD |
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-7183271-B2 | 4,4-difluoro-1,2,3,4-tetrahydro-5h-1-benzazepine derivative or salt thereof | ASTELLAS PHARMA INC. (JP) | 2007-02-27 | — | — | US | claimed |