Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.46 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.46 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.46 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CAMKK1 | Q8N5S9 | 1/20 | 0.42 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 4/20 | 0.42 |
| ▸ | HTR2A | P28223 | 4/20 | 0.42 |
| ▸ | DRD3 | P35462 | 4/20 | 0.42 |
| ▸ | AR | P10275 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL21146433 | 0.82 | IDO1 (0.43) | IDO1CAMKK1CAMKK2DRD2HTR2A | |
| SCHEMBL21052509 | 0.82 | IDO1 (0.43) | IDO1CAMKK1CAMKK2DRD2HTR2A | |
| SCHEMBL21052508 | 0.82 | IDO1 (0.43) | IDO1CAMKK1CAMKK2DRD2HTR2A | |
| SCHEMBL21146772 | 0.82 | IDO1 (0.43) | IDO1CAMKK1CAMKK2DRD2HTR2A | |
| SCHEMBL29392938 | 0.81 | MAPT (0.54) | RAB9ANPC1TP53MAPTPTK2B | |
| SCHEMBL17075123 | 0.81 | MAPT (0.54) | RAB9ANPC1TP53MAPTPTK2B | |
| SCHEMBL22424952 | 0.81 | P2RX7 (0.56) | IDO1CYP2C9RAB9ATP53SMN1; SMN2 | |
| SCHEMBL22424964 | 0.81 | P2RX7 (0.56) | IDO1CYP2C9RAB9ATP53SMN1; SMN2 | |
| SCHEMBL21146333 | 0.81 | P2RX7 (0.56) | IDO1CYP2C9RAB9ATP53SMN1; SMN2 | |
| SCHEMBL28304231 | 0.79 | NPY5R (0.45) | IDO1CYP2C9RAB9ANPC1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-111417626-A | Modulators of indoleamine2,3-dioxygenase | 葛兰素史克知识产权开发有限公司 | 2020-07-14 | — | — | CN | disclosed |