Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 9/20 | 0.55 |
| ▸ | HPGD | P15428 | 6/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.39 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.39 |
| ▸ | SCD | O00767 | 1/20 | 0.39 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15377806 | 0.94 | HPGD (0.59) | NAMPTHPGDALDH1A1MAPTCA12 | |
| SCHEMBL10210118 | 0.92 | NAMPT (0.55) | NAMPTHPGDALDH1A1MAPTCA12 | |
| SCHEMBL9953234 | 0.92 | NAMPT (0.55) | NAMPTHPGDALDH1A1MAPT | |
| SCHEMBL9953713 | 0.92 | NAMPT (0.67) | NAMPTHPGDALDH1A1MAPT | |
| SCHEMBL15384726 | 0.90 | NAMPT (0.56) | NAMPTHPGDALDH1A1MAPTCA12 | |
| SCHEMBL9954500 | 0.89 | NAMPT (0.53) | NAMPTHPGDALDH1A1MAPTSCD5 | |
| SCHEMBL10210170 | 0.89 | NAMPT (0.57) | NAMPTHPGDALDH1A1MAPT | |
| SCHEMBL9954556 | 0.89 | NAMPT (0.55) | NAMPTHPGDALDH1A1MAPTLMNA | |
| SCHEMBL10211244 | 0.89 | NAMPT (0.51) | NAMPTHPGDALDH1A1MAPTCA12 | |
| SCHEMBL15378190 | 0.89 | NAMPT (0.56) | NAMPTHPGDALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2661428-B1 | QUINOXALINES AND AZA-QUINOXALINES AS CRTH2 RECEPTOR MODULATORS | MERCK SHARP & DOHME (US) | 2017-06-07 | — | — | EP | disclosed |