Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.36 |
| ▸ | TUBB | P07437 | 1/20 | 0.36 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.36 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.36 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.36 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.36 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.36 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.36 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.36 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.36 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.36 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.36 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.36 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.36 |
| ▸ | TUBB1 | Q9H4B7 | 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 | |
|---|---|---|---|---|
| SCHEMBL19864556 | 0.86 | ALDH1A1 (0.35) | CYP2C9HPGDCYP2D6CYP1A2POLB | |
| SCHEMBL19864560 | 0.85 | IDO1 (0.33) | HPGDTUBB4ATUBBTUBA3CTUBA1B | |
| SCHEMBL19864685 | 0.77 | MAPT (0.42) | HPGDPOLBTSHRMAPTRAB9A | |
| SCHEMBL23619081 | 0.75 | MAPK1 (0.39) | IDO1KCNH2 | |
| SCHEMBL23619074 | 0.74 | MAPK1 (0.41) | IDO1KCNH2 | |
| SCHEMBL19864657 | 0.74 | PDE2A (0.36) | IDO1KCNH2CNR2 | |
| SCHEMBL28621550 | 0.71 | ALDH1A1 (0.42) | CYP2C9HPGDCYP1A2KDM4EALDH1A1 | |
| SCHEMBL20572183 | 0.68 | IDO1 (0.44) | CYP2C9KDM4EIDO1KCNH2MAPT | |
| SCHEMBL288294 | 0.67 | IDO1 (0.37) | HPGDPOLBKDM4EALDH1A1IDO1 | |
| SCHEMBL21200395 | 0.66 | POLB (0.42) | CYP2C9HPGDCYP2D6CYP1A2POLB |
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 |