Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CMA1 | P23946 | 1/20 | 0.43 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | PNMT | P11086 | 4/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 3/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 3/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 3/20 | 0.38 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | PGR | P06401 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | TDP2 | O95551 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1396641 | 0.87 | BRD4 (0.44) | CMA1AHRPNMTADRA2AADRA2B | |
| SCHEMBL17252188 | 0.79 | CMA1 (0.43) | CMA1AHRPNMTADRA2AADRA2B | |
| SCHEMBL31243557 | 0.79 | AHR (0.43) | CMA1AHRADRA2AADRA2BADRA2C | |
| SCHEMBL6650084 | 0.79 | KDM4E (0.54) | BRD4GAAL3MBTL1 | |
| SCHEMBL17099478 | 0.78 | CMA1 (0.46) | CMA1AHRPNMTADRA2AADRA2B | |
| SCHEMBL9083985 | 0.75 | PNMT (0.39) | PNMTPGRHTR2B | |
| SCHEMBL1612518 | 0.74 | CMA1 (0.42) | CMA1AHRPNMTADRA2AADRA2B | |
| SCHEMBL6652252 | 0.73 | MAPT (0.58) | PNMTADRA2AADRA2BADRA2CPGR | |
| SCHEMBL6327840 | 0.73 | BRD4 (0.50) | AHRBRD4GAA | |
| SCHEMBL7414360 | 0.73 | HTR5A (0.41) | ADRA2AADRA2BADRA2CPGRGAA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5514690-A | Aminocarbonyl (thiocarbonyl) and cyanoguanidine derivatives of quinoline and indoline | E. R. SQUIBB & SONS, INC. (US) | 1996-05-07 | — | — | US | disclosed |
| EP-0647621-A1 | Aryl and heterocylic cyanoguanidine derivatives | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-04-12 | — | — | EP | disclosed |
| US-5401758-A | Pyridinyl cyanoguanidine compounds | BRISTOL-MYERS SQUIBB COMPANY (US) | 1995-03-28 | — | — | US | disclosed |
| EP-0610553-A1 | Aminocarbonyl (thiocarbonyl) and cyanoguanidine derivatives of quinoline and indoline | E.R. SQUIBB & SONS, INC. (US) | 1994-08-17 | — | — | EP | disclosed |