Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACKR3 | P25106 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | CFTR | P13569 | 3/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TDO2 | P48775 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | IDH1 | O75874 | 1/20 | 0.32 |
| ▸ | IDH2 | P48735 | 1/20 | 0.32 |
| ▸ | SPR | P35270 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27922066 | 0.85 | P2RX7 (0.37) | GAACYP17A1CYP1A2TDO2KDM4E | |
| SCHEMBL12482331 | 0.81 | HCAR1 (0.39) | CYP17A1KDM4E | |
| SCHEMBL23949914 | 0.80 | CYP11B2 (0.39) | CYP17A1 | |
| SCHEMBL10264757 | 0.79 | TDO2 (0.44) | ACKR3SIGMAR1NPC1RAB9ACYP17A1 | |
| SCHEMBL25514014 | 0.79 | ACKR3 (0.40) | ACKR3SIGMAR1GAANPC1RAB9A | |
| SCHEMBL26618162 | 0.77 | ALDH1A1 (0.47) | GAANPC1RAB9AALDH1A1LMNA | |
| SCHEMBL28805916 | 0.77 | TDO2 (0.33) | TDO2ALKBH1IDH1IDH2 | |
| SCHEMBL28803189 | 0.77 | IDH1 (0.34) | IDH1IDH2 | |
| SCHEMBL2609426 | 0.76 | CFTR (0.43) | ACKR3SIGMAR1NPC1RAB9ACFTR | |
| SCHEMBL20162925 | 0.76 | SCD (0.44) | ACKR3SIGMAR1GAACFTRALKBH1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018109271-A1 | NEW BROMODOMAIN INHIBITORS | ORION CORPORATION (FI) | 2018-06-21 | — | — | WO | disclosed |
| WO-2018109271-A1 | NEW BROMODOMAIN INHIBITORS | ORION CORPORATION (FI) | 2018-06-21 | — | — | WO | disclosed |
| EP-2638041-A1 | SUBSTITUTED AZAINDAZOLE COMPOUNDS | Bristol-Myers Squibb Company (US) | 2013-09-18 | — | — | EP | disclosed |
| EP-2593453-A1 | AZAINDAZOLE COMPOUNDS | Bristol-Myers Squibb Company (US) | 2013-05-22 | — | — | EP | disclosed |
| WO-2012064815-A1 | SUBSTITUTED AZAINDAZOLE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-05-18 | — | — | WO | disclosed |
| WO-2012009510-A1 | AZAINDAZOLE COMPOUNDS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2012-01-19 | — | — | WO | disclosed |