Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
| ▸ | DNM1 | Q05193 | 8/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.39 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.39 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9192067 | 0.91 | SPHK1 (0.57) | SPHK1OPRM1DNM1ALDH1A1MEN1 | |
| SCHEMBL5358887 | 0.90 | OPRM1 (0.50) | SPHK1OPRM1DNM1ALDH1A1TDP1 | |
| Water SCHEMBL18549323 | 0.87 | OPRM1 (0.48) | SPHK1OPRM1DNM1ALDH1A1TDP1 | |
| SCHEMBL4584791 | 0.86 | SPHK1 (0.57) | SPHK1OPRM1DNM1ALDH1A1MEN1 | |
| SCHEMBL24392963 | 0.85 | OPRM1 (0.59) | SPHK1OPRM1DNM1ALDH1A1TDP1 | |
| SCHEMBL22571304 | 0.85 | OPRM1 (0.46) | SPHK1OPRM1DNM1ALDH1A1TDP1 | |
| SCHEMBL34890 | 0.85 | TRPV1 (0.44) | SPHK1OPRM1DNM1TSHRTRPV1 | |
| SCHEMBL9191832 | 0.83 | TRPV1 (0.37) | SPHK1OPRM1DNM1ALDH1A1MEN1 | |
| SCHEMBL9186773 | 0.83 | TRPV1 (0.37) | SPHK1ALDH1A1TRPV1 | |
| SCHEMBL18595762 | 0.83 | DNM1 (0.43) | SPHK1OPRM1DNM1ALDH1A1MEN1 |
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 |