Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK8 | P45983 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10268373 | 0.93 | ACACB (0.44) | MAPK8KDM4EHPGDGAAACACB | |
| SCHEMBL18307603 | 0.82 | CTSK (0.42) | ACACBCTSKNQO1MBOAT4 | |
| SCHEMBL10203056 | 0.82 | TDP1 (0.44) | ACACBCTSKTLR8 | |
| SCHEMBL28361389 | 0.78 | NQO1 (0.47) | KDM4EHPGDALDH1A1HTTL3MBTL1 | |
| SCHEMBL4266406 | 0.77 | MAPK8 (0.45) | MAPK8HPGDGAACYP2D6CYP3A4 | |
| SCHEMBL18081852 | 0.77 | MAPK8 (0.45) | MAPK8HPGDGAACYP2D6CYP3A4 | |
| SCHEMBL24351035 | 0.76 | HRH4 (0.51) | MAPK8ACACBCTSKNPC1TLR8 | |
| SCHEMBL16631783 | 0.75 | MAPK8 (0.44) | MAPK8CYP2D6CYP3A4CYP19A1CYP1A2 | |
| SCHEMBL16631778 | 0.75 | MCHR1 (0.47) | MAPK8KDM4ECYP2D6CYP3A4HTT | |
| SCHEMBL25211118 | 0.75 | CTSS (0.39) | ALDH1A1L3MBTL1MAPTCYP1A2CYP2C19 |
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-9403782-B2 | Fused heterocyclic compounds as ion channel modulators | GILEAD SCIENCES, INC. (US) | 2016-08-02 | — | — | US | disclosed |
| US-9115096-B2 | Fused heterocyclic compounds as ion channel modulators | GILEAD SCIENCES, INC. (US) | 2015-08-25 | — | — | US | disclosed |