Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | MAOA | P21397 | 2/20 | 0.52 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.52 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.46 |
| ▸ | HRH1 | P35367 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27173946 | 0.82 | CYP2D6 (0.68) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL19628486 | 0.79 | TAAR1 (0.52) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL7361545 | 0.79 | TAAR1 (0.44) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL20495643 | 0.79 | CYP2D6 (0.53) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL10202821 | 0.77 | EPHX1 (0.64) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| SCHEMBL28200559 | 0.77 | EPHX1 (0.64) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| SCHEMBL31118025 | 0.77 | CYP2D6 (0.61) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL8488432 | 0.76 | HTR2A (0.40) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL8664619 | 0.75 | HTR2A (0.54) | CYP2D6SLC6A2TAAR1MAOASLC6A4 | |
| SCHEMBL8512221 | 0.74 | TAAR1 (0.50) | CYP2D6SLC6A2TAAR1MAOASLC6A4 |
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-0530696-B1 | Process for the preparation of pentane 1,5-diamines | BASF AG (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5344983-A | Selective preparation of linear pentane-1,5-diamines in increased yields | BASF AKTIENGESELLSCHAFT (DE) | 1994-09-06 | — | — | US | disclosed |
| EP-0530696-A2 | Process for the preparation of pentane 1,5-diamines | BASF Aktiengesellschaft (DE) | 1993-03-10 | — | — | EP | disclosed |