Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCL8 | P10145 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 6/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | FLT4 | P35916 | 3/20 | 0.32 |
| ▸ | KDR | P35968 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL2497541 | 0.86 | CXCL8 (0.39) | CXCL8PARP1PDPK1CA12ALOX15 | |
| SCHEMBL7036443 | 0.82 | PARP1 (0.34) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL2817264 | 0.82 | PARP1 (0.34) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL22559041 | 0.80 | CYP1A2 (0.39) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL7727344 | 0.80 | TAAR1 (0.40) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL2495510 | 0.78 | PARP1 (0.34) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL2820806 | 0.77 | PARP1 (0.56) | CXCL8PARP1 | |
| SCHEMBL14477036 | 0.74 | TSHR (0.42) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL663849 | 0.73 | PARP1 (0.56) | PARP1PDPK1CA12ALOX15SMN1; SMN2 | |
| SCHEMBL2496016 | 0.73 | PARP1 (0.35) | PARP1PDPK1CA12ALOX15SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010110686-A1 | PYRIMIDINYL AND 1,3,5 TRIAZINYL BENZIMIDAZOLES AND THEIR USE IN CANCER THERAPY | PATHWAY THERAPEUTICS LIMITED (NZ) | 2010-09-30 | — | — | WO | disclosed |