Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.47 |
| ▸ | MTOR | P42345 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 3/20 | 0.46 |
| ▸ | CDK8 | P49336 | 4/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.43 |
| ▸ | CCND1 | P24385 | 1/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.43 |
| ▸ | CDK7 | P50613 | 1/20 | 0.43 |
| ▸ | CDK9 | P50750 | 1/20 | 0.43 |
| ▸ | CCNH | P51946 | 1/20 | 0.43 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.43 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.43 |
| ▸ | BRAF | P15056 | 1/20 | 0.43 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1369411 | 0.99 | TNIK (0.49) | TNIKPIK3CAMTORHTR2CCDK8 | |
| SCHEMBL1365529 | 0.80 | MEN1 (0.60) | HTR2CCDK8BRAFGAAMEN1 | |
| Hydrochloric Acid SCHEMBL1369412 | 0.79 | MEN1 (0.59) | HTR2CCDK8BRAFGAAMEN1 | |
| SCHEMBL4120142 | 0.76 | BRAF (0.53) | HTR2CCDK8BRAFPKMGAA | |
| Hydrochloric Acid SCHEMBL4518253 | 0.75 | BRAF (0.52) | HTR2CCDK8BRAFPKMGAA | |
| SCHEMBL1367961 | 0.75 | PIK3CA (0.47) | TNIKPIK3CAMTORBRAFKIT | |
| SCHEMBL1368092 | 0.74 | PIK3CA (0.48) | TNIKPIK3CAMTORCDK8CCNT1 | |
| SCHEMBL1368343 | 0.74 | CDK8 (0.47) | TNIKPIK3CAMTORCDK8CCNT1 | |
| SCHEMBL1368665 | 0.74 | TNIK (0.56) | TNIKPIK3CAMTORCDK8CCNT1 | |
| SCHEMBL1368105 | 0.73 | TBK1 (0.51) | TNIKPIK3CAMTORCDK8CCNT1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8067599-B2 | Imidazo [4,5-B] pyridine and pyrrolo [2,3-B] pyridine protein kinase inhibitors | HOFFMAN-LA ROCHE INC. (US) | 2011-11-29 | — | — | US | disclosed |