Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 18/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL13914089 | 0.96 | ADORA1 (0.62) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13913996 | 0.92 | KDM4E (0.59) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13913930 | 0.91 | ADORA1 (0.63) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13913915 | 0.91 | ADORA1 (0.63) | ADORA1KDM4ENPSR1ADORA2BHTT | |
| SCHEMBL13914066 | 0.89 | ADORA1 (0.70) | ADORA1ADORA2B | |
| SCHEMBL13913863 | 0.89 | ADORA1 (0.66) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13914049 | 0.89 | ADORA1 (0.56) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13914050 | 0.88 | ADORA1 (0.52) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13913992 | 0.86 | ADORA1 (0.64) | ADORA1KDM4ENPSR1USP2ALDH1A1 | |
| SCHEMBL13914091 | 0.85 | ADORA1 (0.52) | ADORA1KDM4ENPSR1USP2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7504421-B2 | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and their use | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |
| US-7504421-B2 | Substituted 2-thio-3,5-dicyano-4-aryl-6-aminopyridines and their use | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2009-03-17 | — | — | US | disclosed |