Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 3/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.42 |
| ▸ | DRD2 | P14416 | 2/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL4681635 | 0.86 | LTA4H (0.44) | LTA4HCHRM1DRD2ATMDRD3 | |
| SCHEMBL4681639 | 0.82 | LTA4H (0.44) | LTA4HCHRM1DRD2ATMDRD3 | |
| SCHEMBL12337290 | 0.82 | EPHX1 (0.54) | LTA4HATMEPHX2EPHX1ALDH1A1 | |
| SCHEMBL23173205 | 0.82 | SIGMAR1 (0.38) | DRD2DRD3EPHX2EPHX1ALDH1A1 | |
| SCHEMBL14527915 | 0.81 | LTA4H (0.43) | LTA4HCHRM1DRD2ATMDRD3 | |
| SCHEMBL4681787 | 0.80 | CHRM1 (0.48) | LTA4HCHRM1DRD2ATMDRD3 | |
| SCHEMBL13136091 | 0.79 | EPHX1 (0.56) | LTA4HEPHX2EPHX1ALDH1A1KDM4E | |
| SCHEMBL8144691 | 0.79 | LTA4H (0.48) | LTA4HCHRM1DRD2DRD3EPHX2 | |
| SCHEMBL669964 | 0.79 | LTA4H (0.45) | LTA4HDRD2DRD3ALDH1A1 | |
| SCHEMBL7284403 | 0.78 | LTA4H (0.41) | LTA4HCHRM1DRD2ATMDRD3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3054955-B1 | PYRROLOTRIAZINE KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2018-05-30 | — | — | EP | disclosed |