Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 1/20 | 0.34 |
| ▸ | VDR | P11473 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | DHODH | Q02127 | 3/20 | 0.33 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
| ▸ | CDK4 | P11802 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | NOS3 | P29474 | 1/20 | 0.32 |
| ▸ | NOS1 | P29475 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 2/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.31 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.31 |
| ▸ | VNN1 | O95497 | 1/20 | 0.31 |
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 SCHEMBL1738281 | 0.99 | PDE2A (0.34) | PDE2AVDRCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL1737587 | 0.92 | SMN1; SMN2 (0.34) | CYP1A2CYP3A4CYP2C9CYP2C19CDK4 | |
| Hydrochloric Acid SCHEMBL1735390 | 0.91 | SMN1; SMN2 (0.34) | CYP1A2CYP3A4CYP2C9CYP2C19CDK4 | |
| SCHEMBL1738310 | 0.90 | CYP1A2 (0.36) | CYP1A2CYP3A4CYP2C9CYP2C19CDK4 | |
| Hydrochloric Acid SCHEMBL1736913 | 0.89 | CYP1A2 (0.35) | CYP1A2CYP3A4CYP2C9CYP2C19CDK4 | |
| SCHEMBL1738138 | 0.88 | CYP1A2 (0.35) | VDRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1738232 | 0.88 | CYP1A2 (0.38) | VDRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL1736170 | 0.87 | CYP1A2 (0.34) | VDRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL1736644 | 0.87 | CYP1A2 (0.38) | VDRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1737196 | 0.83 | MAPK13 (0.35) | CYP1A2CYP3A4CYP2C9CYP2C19CDK4 |
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-1784404-B1 | PYRROLO[2,3-C]PYRIDINE DERIVATIVES AND PROCESSES FOR THE PREPARATION THEREOF | YUHAN CORP (KR) | 2011-11-16 | — | — | EP | claimed |
| US-20110263306-A1 | COMPUTER SYSTEM AND PROGRAM | NAMCO BANDAI GAMES INC. (JP) | 2011-10-27 | — | — | US | claimed |