Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | RAB9A | P51151 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | GFER | P55789 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11740985 | 1.00 | GRM5 (0.57) | GRM5NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11740926 | 0.94 | GRM5 (0.63) | GRM5NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11740932 | 0.94 | GRM5 (0.63) | GRM5NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11742691 | 0.88 | GRM5 (0.65) | GRM5NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11741819 | 0.86 | GRM5 (0.67) | GRM5RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL11741813 | 0.86 | GRM5 (0.67) | GRM5RAB9ASMN1; SMN2MAPTKDM4E | |
| SCHEMBL11738695 | 0.86 | GRM5 (0.67) | GRM5NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11738699 | 0.86 | GRM5 (0.67) | GRM5NPC1RAB9AKMT2AMEN1 | |
| SCHEMBL11744367 | 0.86 | GRM5 (0.54) | GRM5RAB9AKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL11744375 | 0.86 | GRM5 (0.54) | GRM5RAB9AKMT2AMEN1SMN1; SMN2 |
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-4046909-A | Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants | MCNEIL LABORATORIES, INCORPORATED (US) | 1977-09-06 | — | — | US | disclosed |
| US-3998958-A | Pyrrolidylidene, piperidylidene and hexahydroazepinylidene ureas as CNS depressants | MCNEIL LABORATORIES, INCORPORATED (US) | 1976-12-21 | — | — | US | disclosed |