Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | OGA | O60502 | 2/20 | 0.44 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | SOS1 | Q07889 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL14035488 | 1.00 | CHRM2 (0.49) | CHRM2CHRM1CYP2D6CYP19A1OGA | |
| SCHEMBL14035317 | 1.00 | CHRM2 (0.49) | CHRM2CHRM1CYP2D6CYP19A1OGA | |
| SCHEMBL12656443 | 0.90 | OGA (0.40) | CHRM2CHRM1CYP2D6CYP19A1OGA | |
| SCHEMBL11625076 | 0.88 | CHRM2 (0.48) | CHRM2CHRM1CYP2D6CYP19A1OGA | |
| SCHEMBL14035487 | 0.83 | CHRM2 (0.44) | CHRM2CHRM1CYP2D6CYP19A1OGA | |
| SCHEMBL3909083 | 0.83 | CYP2D6 (0.61) | CYP2D6CYP19A1MEN1KMT2AOPRD1 | |
| SCHEMBL2264525 | 0.81 | CHRM2 (0.56) | CHRM2CHRM1CYP2D6CYP19A1SIGMAR1 | |
| SCHEMBL659199 | 0.81 | CHRM2 (0.56) | CHRM2CHRM1CYP2D6CYP19A1SIGMAR1 | |
| SCHEMBL3844765 | 0.81 | CHRM2 (0.56) | CHRM2CHRM1CYP2D6CYP19A1SIGMAR1 | |
| SCHEMBL4094531 | 0.80 | HRH3 (0.39) | CHRM2CHRM1OGAHSD11B1SIGMAR1 |
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-0925302-A1 | PALLADIUM CATALYZED INDOLIZATION | Merck & Co., Inc. (US) | 1999-06-30 | — | — | EP | claimed |
| WO-1998006725-A1 | PALLADIUM CATALYZED INDOLIZATION | MERCK & CO., INC. (US) | 1998-02-19 | — | — | WO | claimed |