Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP2 | O95551 | 1/20 | 0.40 |
| ▸ | AHR | P35869 | 3/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.39 |
| ▸ | DRD3 | P35462 | 2/20 | 0.39 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.39 |
| ▸ | CACNG8 | Q8WXS5 | 1/20 | 0.39 |
| ▸ | CMA1 | P23946 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3139769 | 0.86 | PGR (0.43) | DRD2DRD4DRD3SRD5A1PGR | |
| SCHEMBL29622013 | 0.82 | AHR (0.48) | AHRPDK2DRD2DRD4DRD3 | |
| SCHEMBL261277 | 0.82 | AHR (0.48) | AHRPDK2DRD2DRD4DRD3 | |
| SCHEMBL153534 | 0.81 | CCNB2 (0.44) | AHRPDK2DRD2DRD4DRD3 | |
| SCHEMBL2076100 | 0.78 | AHR (0.43) | AHRPDK2DRD2DRD4DRD3 | |
| SCHEMBL22904178 | 0.75 | TDP2 (0.64) | TDP2AHRPDK2SRD5A1MEN1 | |
| SCHEMBL23252642 | 0.75 | AHR (0.41) | AHRPDK2DRD2DRD4DRD3 | |
| SCHEMBL19235316 | 0.75 | AHR (0.41) | AHRPDK2DRD2DRD4DRD3 | |
| SCHEMBL3136744 | 0.75 | AHR (0.41) | TDP2AHRPDK2DRD2DRD4 | |
| SCHEMBL31414332 | 0.75 | AHR (0.49) | TDP2AHRPDK2DRD2DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101675061-A | pyrrolo-N-heterocyclic derivatives, process for their preparation and their use in medicine | SHANGHAI HENGRUI PHARM CO LTD | 2010-03-17 | — | — | CN | disclosed |