Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 7/20 | 0.72 |
| ▸ | PLAU | P00749 | 1/20 | 0.55 |
| ▸ | ANPEP | P15144 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3087762 | 0.84 | IDO1 (1.00) | IDO1PLAUANPEPCA1CA2 | |
| SCHEMBL11852553 | 0.83 | PLAU (0.54) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL6570375 | 0.79 | CYP1A2 (0.51) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL6311069 | 0.79 | CYP1A2 (0.51) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL22524385 | 0.79 | CYP1A2 (0.51) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL13456262 | 0.76 | PLAU (0.47) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL11555929 | 0.75 | PLAU (0.46) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL10447404 | 0.75 | CYP1A2 (0.55) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL8530045 | 0.74 | IDO1 (0.44) | IDO1PLAUANPEPHTR2CSLC6A4 | |
| SCHEMBL26944395 | 0.73 | IDO1 (0.43) | IDO1PLAUANPEPHTR2CSLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2032585-B1 | SUBSTITUTED PTERIDINES AS THERAPEUTIC AGENTS | BOEHRINGER INGELHEIM INT (DE) | 2014-07-23 | — | — | EP | disclosed |
| WO-2007135026-A2 | SUBSTITUTED PTERIDINES AS THERAPEUTIC AGENTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-11-29 | — | — | WO | disclosed |