Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMO | O15229 | 1/20 | 0.34 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.33 |
| ▸ | GNE | Q9Y223 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL19864560 | 0.89 | IDO1 (0.33) | HPGDCYP17A1IDO1KCNH2SCN9A | |
| SCHEMBL19859201 | 0.86 | CYP2C9 (0.37) | ALDH1A1POLBHPGDCYP1A2CYP2D6 | |
| SCHEMBL19864684 | 0.77 | PIM1 (0.34) | ALDH1A1POLBHPGDCYP1A2CYP2C9 | |
| SCHEMBL19864685 | 0.77 | MAPT (0.42) | POLBHPGDSMN1; SMN2MAPTKMT2A | |
| SCHEMBL23619081 | 0.74 | MAPK1 (0.39) | IDO1KCNH2 | |
| SCHEMBL23619074 | 0.74 | MAPK1 (0.41) | IDO1KCNH2 | |
| SCHEMBL19864657 | 0.73 | PDE2A (0.36) | IDO1KCNH2 | |
| SCHEMBL23611056 | 0.71 | USP30 (0.42) | ALDH1A1POLBHPGDKCNH2SCN9A | |
| SCHEMBL29133297 | 0.65 | KDM4E (0.38) | ALDH1A1HPGDIDO1KCNH2GNE | |
| SCHEMBL19859191 | 0.64 | GRM5 (0.33) | ALDH1A1POLBHPGDCYP1A2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018030550-A1 | HETEROCYCLIC COMPOUNDS WITH AN ROR(GAMMA)T MODULATING ACTIVITY | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-02-15 | — | — | WO | disclosed |