Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL335774 | 0.84 | GAA (0.47) | KDM4EHTTHPGDLMNAGAA | |
| SCHEMBL4114108 | 0.81 | CXCL8 (0.41) | ADRB2ADRB1CYP2D6CXCL8CTSA | |
| SCHEMBL335285 | 0.76 | HDAC1 (0.46) | KDM4EHPGDLMNAGAACYP1A2 | |
| SCHEMBL335542 | 0.75 | POLB (0.46) | KDM4EHTTHPGDLMNACYP3A4 | |
| SCHEMBL15067442 | 0.72 | ADRB2 (0.45) | ADRB2ADRB1CYP2D6CXCL8CTSA | |
| SCHEMBL15067585 | 0.72 | ADRB2 (0.45) | ADRB2ADRB1CYP2D6CXCL8CTSA | |
| SCHEMBL15067895 | 0.72 | ADRB2 (0.45) | ADRB2ADRB1CYP2D6CXCL8CTSA | |
| SCHEMBL17093266 | 0.70 | CXCL8 (0.44) | KDM4EHTTADRB2ADRB1CYP2D6 | |
| SCHEMBL11244690 | 0.70 | CXCL8 (0.44) | HPGDLMNAADRB2ADRB1CYP1A2 | |
| SCHEMBL17093326 | 0.70 | CXCL8 (0.44) | KDM4EHTTADRB2ADRB1CYP2D6 |
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-8097758-B2 | Isoserine derivatives for use as coagulation factor IXa inhibitors | SANOFI-AVENTIS (FR) | 2012-01-17 | — | — | US | disclosed |