Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.34 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.34 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
| ▸ | FPR2 | P25090 | 2/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.32 |
| ▸ | FEN1 | P39748 | 1/20 | 0.32 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.32 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.31 |
| ▸ | SSTR3 | P32745 | 1/20 | 0.31 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9405701 | 1.00 | KDM1A (0.36) | KDM1AGRIN1GRIN2BTRPV3L3MBTL1 | |
| SCHEMBL12716045 | 1.00 | KDM1A (0.36) | KDM1AGRIN1GRIN2BTRPV3L3MBTL1 | |
| SCHEMBL5849019 | 0.96 | KDM1A (0.34) | KDM1AGRIN1GRIN2BTRPV3FPR2 | |
| SCHEMBL9630260 | 0.96 | OPRL1 (0.34) | KDM1AGRIN1GRIN2BOPRL1HPGD | |
| SCHEMBL26209549 | 0.96 | KDM1A (0.34) | KDM1AGRIN1GRIN2BTRPV3FPR2 | |
| SCHEMBL9631105 | 0.96 | KDM1A (0.34) | KDM1AGRIN1GRIN2BTRPV3FPR2 | |
| SCHEMBL7935718 | 0.96 | OPRL1 (0.34) | KDM1AGRIN1GRIN2BOPRL1HPGD | |
| SCHEMBL7935723 | 0.96 | OPRL1 (0.34) | KDM1AGRIN1GRIN2BOPRL1HPGD | |
| SCHEMBL9630268 | 0.96 | OPRL1 (0.34) | KDM1AGRIN1GRIN2BOPRL1HPGD | |
| SCHEMBL2213307 | 0.96 | KDM1A (0.34) | KDM1AGRIN1GRIN2BTRPV3FPR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5279764-A | Dihalogenobenzene derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1994-01-18 | — | — | US | disclosed |
| EP-0364538-B1 | DIFLUOROBENZOL DERIVATIVES | MERCK PATENT GmbH (DE) | 1992-05-06 | — | — | EP | disclosed |