Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.74 |
| ▸ | TACR3 | P29371 | 2/20 | 0.74 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.74 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.74 |
| ▸ | FPR1 | P21462 | 1/20 | 0.74 |
| ▸ | GPR183 | P32249 | 1/20 | 0.74 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.74 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.74 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.74 |
| ▸ | TACR2 | P21452 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6604634 | 1.00 | TACR1 (0.74) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL6603279 | 0.92 | TACR1 (0.73) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL6603274 | 0.92 | TACR1 (0.73) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL3370721 | 0.88 | TACR1 (0.58) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL3370718 | 0.88 | TACR1 (0.58) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL3370723 | 0.88 | TACR1 (0.58) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL7759151 | 0.88 | TACR1 (0.58) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL7759145 | 0.88 | TACR1 (0.58) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL8700135 | 0.88 | TACR1 (0.71) | TACR1TACR3NR3C1CYP3A4FPR1 | |
| SCHEMBL29836367 | 0.86 | TACR1 (0.74) | TACR1TACR3NR3C1CYP3A4FPR1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5747491-A | ANALGESICS, ANTIINFLAMMATORY AGENTS, ANTIEMETICS; HEADACHES | MERCK SHARP & DOHME LTD. (GB) | 1998-05-05 | — | — | US | claimed |
| EP-1099702-B1 | Substituted morpholine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME (GB) | 2004-10-06 | — | — | EP | disclosed |
| EP-1462450-A1 | Substituted morpholine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LTD. (GB) | 2004-09-29 | — | — | EP | disclosed |
| EP-1099702-A1 | Substituted morpholine derivatives and their use as therapeutic agents | MERCK SHARP & DOHME LTD. (GB) | 2001-05-16 | — | — | EP | disclosed |
| US-5747491-A | ANALGESICS, ANTIINFLAMMATORY AGENTS, ANTIEMETICS; HEADACHES | MERCK SHARP & DOHME LTD. (GB) | 1998-05-05 | — | — | US | disclosed |
| US-5612337-A | ANALGESIC COMPOUNDS FOR PRODRUGS | MERCK SHARP & DOHME LIMITED (GB) | 1997-03-18 | — | — | US | disclosed |