Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | OPRL1 | P41146 | 6/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.39 |
| ▸ | FPR1 | P21462 | 2/20 | 0.36 |
| ▸ | FPR2 | P25090 | 2/20 | 0.36 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.36 |
| ▸ | PROKR1 | Q8TCW9 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20177704 | 0.81 | MTNR1A (0.48) | HTR2CHTR2AHTR2BOPRL1CHRNB2 | |
| SCHEMBL20177675 | 0.81 | KDM1A (0.45) | ALOX12 | |
| SCHEMBL20177679 | 0.79 | KDM1A (0.44) | HTR2CHTR2AHTR2BCHRNB2CHRNA4 | |
| SCHEMBL20177721 | 0.79 | — | — | |
| SCHEMBL433273 | 0.74 | OPRL1 (0.59) | HTR2CHTR2AHTR2BOPRL1CHRNB2 | |
| SCHEMBL20177951 | 0.73 | HTR3A (0.47) | ALOX12SLC6A2SLC6A4SLC6A3GAA | |
| SCHEMBL29904538 | 0.71 | HTR3A (0.54) | HTR2CHTR2AHTR2BOPRL1CHRNB2 | |
| SCHEMBL1825481 | 0.71 | HTR3A (0.54) | HTR2CHTR2AHTR2BOPRL1CHRNB2 | |
| SCHEMBL434518 | 0.71 | OPRL1 (0.56) | HTR2CHTR2AHTR2BOPRL1CHRNB2 | |
| SCHEMBL433558 | 0.71 | OPRL1 (0.60) | HTR2CHTR2AHTR2BOPRL1PROKR1 |
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-2018092916-A1 | NITROGEN-CONTAINING POLYCYCLIC HETEROCYCLIC DERIVATIVE | 宇部興産株式会社 | 2018-05-24 | — | — | WO | disclosed |