Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.45 |
| ▸ | KCNA5 | P22460 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.42 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 7/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.41 |
| ▸ | SCN1A | P35498 | 3/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 3/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 6/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 4/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL16477945 | 0.83 | KCNA5 (0.53) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL20034107 | 0.83 | KCNA5 (0.53) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL22060302 | 0.83 | KCNA5 (0.53) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL1156021 | 0.83 | KCNA5 (0.53) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL13862942 | 0.83 | KCNA5 (0.52) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL817770 | 0.83 | KCNA5 (0.52) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL10247782 | 0.83 | KCNA5 (0.52) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL13638230 | 0.83 | KCNA5 (0.52) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL1246151 | 0.80 | KCNA5 (0.50) | KCNH2KCNA5TSHRCYP2D6KCNE1 | |
| SCHEMBL27757299 | 0.80 | KCNA5 (0.48) | KCNH2KCNA5TSHRCYP2D6KCNE1 |
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-4086290-A | CATALYST OF IRON-PHOSPHORUS-BORON, ALUMINUM, INDIUM OR THALLIUM OXIDES | PHILLIPS PETROLEUM COMPANY (US) | 1978-04-25 | — | — | US | disclosed |
| US-3993591-A | IRON, PHOSPHORUS AND GROUP IIIA COMPONENTS AS CATALYSTS | PHILLIPS PETROLEUM COMPANY (US) | 1976-11-23 | — | — | US | disclosed |