Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NQO2 | P16083 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.36 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | RXRB | P28702 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9896020 | 0.81 | MTNR1A (0.43) | MCL1ALDH1A1POLBNQO2MTNR1A | |
| SCHEMBL12164519 | 0.79 | ALDH1A1 (0.42) | MCL1ALDH1A1POLBCYP3A4HSD17B10 | |
| SCHEMBL11009783 | 0.78 | CYP3A4 (0.57) | ALDH1A1POLBCYP3A4HPGDKDM4E | |
| SCHEMBL4050941 | 0.77 | NPC1 (0.45) | ALDH1A1POLBCYP3A4TSHRNPSR1 | |
| SCHEMBL8773218 | 0.77 | MAPT (0.37) | MCL1ALDH1A1POLBNQO2MTNR1A | |
| SCHEMBL7386199 | 0.76 | NPSR1 (0.59) | MCL1POLBNPSR1AKR1C3AKR1C2 | |
| SCHEMBL28346847 | 0.76 | HSD17B1 (0.47) | ALDH1A1CYP3A4HPGDKDM4EGAA | |
| SCHEMBL1922484 | 0.74 | MAPT (0.43) | ALDH1A1POLBCYP3A4HPGDGAA | |
| SCHEMBL14232910 | 0.74 | P2RX7 (0.45) | ALDH1A1CYP3A4MAPTNPSR1RXRA | |
| SCHEMBL27350708 | 0.73 | MAPT (0.37) | MCL1ALDH1A1POLBCYP3A4HSD17B10 |
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-2328902-A1 | PYRAZOLO [5,1-B]OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS | Novartis AG (CH) | 2011-06-08 | — | — | EP | disclosed |
| WO-2010015628-A1 | PYRAZOLO [5,1-B] OXAZOLE DERIVATIVES AS CRF1 ANTAGONISTS | NOVARTIS AG (CH) | 2010-02-11 | — | — | WO | disclosed |