Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.56 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.54 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.45 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | SPHK2 | Q9NRA0 | 2/20 | 0.44 |
| ▸ | SPHK1 | Q9NYA1 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5195704 | 0.88 | SPHK2 (0.52) | SIGMAR1ALDH1A1SPHK2 | |
| SCHEMBL5193849 | 0.86 | HRH3 (0.60) | HRH3SIGMAR1DRD2 | |
| SCHEMBL5191198 | 0.86 | MAPK1 (0.56) | SIGMAR1ALDH1A1TSHRKMT2ACHRM3 | |
| SCHEMBL5193949 | 0.84 | OPRD1 (0.45) | HRH3SIGMAR1KMT2AOPRD1SPHK2 | |
| SCHEMBL6807045 | 0.84 | HRH3 (0.63) | HRH3TRPV6SIGMAR1SPHK2SPHK1 | |
| SCHEMBL6807049 | 0.84 | HRH3 (0.63) | HRH3TRPV6SIGMAR1SPHK2SPHK1 | |
| SCHEMBL9372352 | 0.84 | HRH3 (0.63) | HRH3TRPV6SIGMAR1SPHK2SPHK1 | |
| SCHEMBL15173715 | 0.83 | HRH3 (0.59) | HRH3TRPV6SIGMAR1ALDH1A1TSHR | |
| SCHEMBL9374317 | 0.80 | HRH3 (0.68) | HRH3TRPV6SIGMAR1SPHK2SPHK1 | |
| SCHEMBL9372055 | 0.80 | HRH3 (0.68) | HRH3TRPV6SIGMAR1SPHK2SPHK1 |
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-0968206-B8 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX INC (US) | 2007-01-24 | — | — | EP | disclosed |
| EP-0968206-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 2000-01-05 | — | — | EP | disclosed |
| WO-1998037079-A1 | N-HETEROCYCLIC DERIVATIVES AS NOS INHIBITORS | BERLEX LABORATORIES, INC. (US) | 1998-08-27 | — | — | WO | disclosed |