Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.43 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL5322380 | 0.87 | IDO1 (0.52) | IDO1HSPA5AKR1B1GAATSHR | |
| SCHEMBL1178804 | 0.85 | IDO1 (0.53) | IDO1HSPA5AKR1B1GAATSHR | |
| SCHEMBL9494548 | 0.82 | IDO1 (0.47) | IDO1HSPA5AKR1B1GAATSHR | |
| SCHEMBL12732386 | 0.81 | IDO1 (0.50) | IDO1HSPA5AKR1B1GAATSHR | |
| SCHEMBL926056 | 0.79 | IDO1 (0.52) | IDO1HSPA5AKR1B1GAATSHR | |
| SCHEMBL28727309 | 0.76 | ALDH1A1 (0.48) | IDO1HSPA5AKR1B1TSHR | |
| SCHEMBL30705776 | 0.75 | TSHR (0.55) | IDO1AKR1B1TSHRKEAP1 | |
| SCHEMBL21446960 | 0.75 | TSHR (0.55) | IDO1AKR1B1TSHRKEAP1 | |
| SCHEMBL28208046 | 0.75 | TSHR (0.49) | IDO1HSPA5AKR1B1TSHR | |
| SCHEMBL8091988 | 0.75 | IDO1 (0.43) | IDO1HSPA5AKR1B1GAATSHR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007110624-A2 | IMMOBILISED REAGENT | UNIVERSITY COURT OF THE UNIVERSITY OFEDINBURGH (GB) | 2007-10-04 | — | — | WO | claimed |
| WO-2007110624-A2 | IMMOBILISED REAGENT | UNIVERSITY COURT OF THE UNIVERSITY OFEDINBURGH (GB) | 2007-10-04 | — | — | WO | disclosed |