Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | HTR2C | P28335 | 2/20 | 0.53 |
| ▸ | HTR2B | P41595 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.52 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.51 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.51 |
| ▸ | CNR1 | P21554 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA7 | P43166 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21540797 | 0.85 | HTR2C (0.57) | KDM4EHTR2CHTR2BALDH1A1POLB | |
| SCHEMBL13570736 | 0.83 | CCNA2 (0.50) | KDM4EHTR2CHTR2BPOLB | |
| SCHEMBL21540592 | 0.82 | KDM4E (0.76) | KDM4EALDH1A1CA1CA2CA9 | |
| SCHEMBL21540800 | 0.82 | TAAR1 (0.63) | KDM4EHTR2CHTR2BRAB9ACNR1 | |
| SCHEMBL2089855 | 0.81 | HTR2C (0.60) | HTR2CHTR2BRAB9AALDH1A1POLB | |
| SCHEMBL2089398 | 0.81 | HTR2C (0.60) | HTR2CHTR2BRAB9AALDH1A1POLB | |
| SCHEMBL2089397 | 0.81 | HTR2C (0.60) | HTR2CHTR2BRAB9AALDH1A1POLB | |
| Hydrochloric Acid SCHEMBL11095820 | 0.80 | HTR2C (0.59) | HTR2CHTR2BRAB9AALDH1A1POLB | |
| SCHEMBL5193856 | 0.79 | KDM4E (0.55) | KDM4ERAB9AMTNR1AMTNR1BCNR1 | |
| SCHEMBL24322439 | 0.77 | TAAR1 (0.62) | KDM4EHTR2CHTR2BRAB9AALDH1A1 |
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 |