Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 4/20 | 0.41 |
| ▸ | HCRTR2 | O43614 | 6/20 | 0.40 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.38 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5836860 | 0.95 | HTR2C (0.39) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL5836857 | 0.95 | HTR2C (0.39) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL5836864 | 0.95 | HTR2C (0.39) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL9406090 | 0.88 | TRPV3 (0.38) | OPRL1TRPV3 | |
| SCHEMBL9406095 | 0.88 | TRPV3 (0.38) | OPRL1TRPV3 | |
| SCHEMBL716244 | 0.87 | OPRL1 (0.45) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL28483699 | 0.87 | OPRL1 (0.45) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL13293471 | 0.86 | HTR2C (0.40) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL7566938 | 0.85 | OPRL1 (0.44) | HTR2CHTR2BOPRL1HCRTR2HTR1A | |
| SCHEMBL7566933 | 0.85 | OPRL1 (0.44) | HTR2CHTR2BOPRL1HCRTR2HTR1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0363458-B1 | 2,3-DIFLUOROBENZENES | MERCK PATENT GMBH (DE) | 1994-08-03 | — | — | EP | disclosed |
| US-5087764-A | Deprotonation of a 1-substituted-2,3-difluorobenzene using an organometallic compound and reacting the reaction product with an electrophile | Merck Patent Gesellschaft mit beschrankter Hafung (DE) | 1992-02-11 | — | — | US | disclosed |