Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN1 | Q05586 | 3/20 | 0.46 |
| ▸ | GRIN2A | Q12879 | 3/20 | 0.46 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.46 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.46 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.46 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | PRCP | P42785 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.46 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.45 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.39 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1626961 | 0.73 | OPRM1 (0.40) | GRIN1GRIN2AGRIN2BGRIN2DGRIN3B | |
| SCHEMBL28870944 | 0.73 | OPRM1 (0.37) | GRIN1GRIN2AGRIN2BGRIN2DGRIN3B | |
| SCHEMBL902318 | 0.73 | SLC6A2 (0.36) | GRIN1GRIN2AGRIN2BGRIN2DGRIN3B | |
| SCHEMBL16024156 | 0.69 | OPRM1 (0.54) | SLC6A2SLC6A4SLC6A3OPRM1OPRD1 | |
| SCHEMBL1040389 | 0.69 | OPRM1 (0.54) | SLC6A2SLC6A4SLC6A3OPRM1OPRD1 | |
| SCHEMBL1040539 | 0.69 | OPRM1 (0.54) | SLC6A2SLC6A4SLC6A3OPRM1OPRD1 | |
| SCHEMBL10793672 | 0.67 | KDM1A (0.45) | GRIN1GRIN2AGRIN2BGRIN2DGRIN3B | |
| SCHEMBL14899046 | 0.66 | OPRM1 (0.56) | SLC6A2SLC6A4OPRM1OPRD1OPRL1 | |
| SCHEMBL28897962 | 0.65 | GRIN1 (0.30) | GRIN1GRIN2AGRIN2B | |
| SCHEMBL27726288 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1432011-A | Benzoamide piperidine compounds as substance P antagonists | PFIZER PROD INC (US) | 2003-07-23 | — | — | CN | disclosed |