Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NNMT | P40261 | 1/20 | 0.45 |
| ▸ | GCK | P35557 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.36 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.34 |
| ▸ | DHFR | P00374 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.33 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL22145148 | 0.82 | NNMT (0.50) | NNMTCYP2A6DHFRMEN1PABPC1 | |
| SCHEMBL20095717 | 0.81 | FFAR1 (0.48) | NNMTFFAR1MEN1KMT2A | |
| SCHEMBL18396986 | 0.79 | NNMT (0.44) | NNMTCYP2A6FFAR1MTNR1AMTNR1B | |
| SCHEMBL2542011 | 0.79 | MTNR1A (0.36) | NNMTGCKTNKS2MTNR1AMTNR1B | |
| SCHEMBL10263430 | 0.77 | NOS3 (0.55) | NNMTCYP2A6DHFRMEN1PABPC1 | |
| SCHEMBL29863385 | 0.77 | HTR2A (0.41) | NNMTMTNR1AMTNR1BNOS1 | |
| SCHEMBL21459468 | 0.77 | HTR2A (0.41) | NNMTMTNR1AMTNR1BNOS1 | |
| SCHEMBL22145202 | 0.75 | NNMT (0.46) | NNMTCYP2A6DHFRMEN1PABPC1 | |
| SCHEMBL30987534 | 0.75 | NNMT (0.46) | NNMTCYP2A6DHFRMEN1PABPC1 | |
| SCHEMBL21327094 | 0.75 | NNMT (0.50) | NNMTCYP2A6FFAR1DHFRMEN1 |
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 |