Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 4/20 | 0.37 |
| ▸ | HTR2A | P28223 | 4/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.36 |
| ▸ | PNMT | P11086 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL10922504 | 0.74 | OPRM1 (0.40) | HTR2AHTR2CSLC6A2SLC6A4DRD2 | |
| SCHEMBL31077650 | 0.70 | HTR2A (0.46) | NPC1RAB9APGRHTR2AHTR2C | |
| SCHEMBL1334863 | 0.69 | HTR2A (0.44) | HTR2ASLC6A2SLC6A4CYP1A2MAOA | |
| SCHEMBL26633128 | 0.69 | SLC6A2 (0.33) | SLC6A2SLC6A4PNMTHTR2BHTR7 | |
| Bromide SCHEMBL5224748 | 0.67 | HTR2A (0.43) | HTR2ASLC6A2SLC6A4CYP1A2MAOA | |
| SCHEMBL30901957 | 0.66 | PNMT (0.45) | NPC1RAB9APGRHTR2AHTR2C | |
| SCHEMBL524602 | 0.65 | PNMT (0.63) | NPC1RAB9APGRPNMTDRD2 | |
| SCHEMBL30103334 | 0.65 | PNMT (0.63) | NPC1RAB9APGRPNMTDRD2 | |
| SCHEMBL21887958 | 0.64 | LMNA (0.45) | NPC1RAB9APGRPNMTHTR2B | |
| SCHEMBL2877998 | 0.63 | PNMT (0.61) | NPC1RAB9APGRPNMTDRD2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996024617-A1 | DESAMINONONAPEPTIDES, PROCESS FOR PREPARING THE SAME AND THEIR USE FOR PREPARING ELCATONIN | LONZA AG (CH) | 1996-08-15 | — | — | WO | disclosed |