Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HGFAC | Q04756 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | KDM6B | O15054 | 1/20 | 0.35 |
| ▸ | KDM5C | P41229 | 1/20 | 0.35 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.35 |
| ▸ | KDM2A | Q9Y2K7 | 1/20 | 0.35 |
| ▸ | KDM3A | Q9Y4C1 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | NR1H4 | Q96RI1 | 3/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL546440 | 0.83 | ALOX15 (0.41) | ALOX15HTTCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL546233 | 0.80 | P2RX3 (0.45) | ALOX15HTTCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL545540 | 0.75 | KDM4E (0.47) | ALOX15HTTCYP19A1CYP11B1CYP11B2 | |
| Hydrochloric Acid SCHEMBL546682 | 0.74 | KDM4E (0.46) | ALOX15HTTCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL19478119 | 0.73 | BRAF (0.58) | KDR | |
| SCHEMBL545151 | 0.73 | KDM4E (0.45) | KDM4EKDM6BKDM5CKDM4CKDM2A | |
| SCHEMBL545876 | 0.70 | P2RX3 (0.46) | KDM4ELCKDYRK1AKDR | |
| SCHEMBL17598755 | 0.69 | ELANE (0.58) | ALOX15HTTCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL27595732 | 0.69 | KDM4E (0.58) | KDM4EALDH1A1HPGDRAB9APLG | |
| SCHEMBL545959 | 0.68 | KDM4E (0.66) | CYP11B1CYP11B2HGFACPTPN11KDM4E |
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-1957460-A1 | BICYCLIC COMPOUNDS WITH KINASE INHIBITORY ACTIVITY | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007067444-A1 | BICYCLIC COMPOUNDS WITH KINASE INHIBITORY ACTIVITY | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2007-06-14 | — | — | WO | disclosed |