Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53BP1 | Q12888 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | VNN1 | O95497 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL4311072 | 0.89 | MRGPRX4 (0.37) | KMT2ANPC1RAB9APPARGPPARA | |
| SCHEMBL4304235 | 0.88 | MAPT (0.37) | KMT2AALDH1A1MAPTKDM4E | |
| SCHEMBL4303399 | 0.83 | LMNA (0.37) | KMT2AALDH1A1MAPTKDM4E | |
| SCHEMBL4302813 | 0.79 | ALDH1A1 (0.35) | KMT2ANPC1RAB9AALDH1A1HTT | |
| SCHEMBL4301399 | 0.78 | CYP1A2 (0.34) | NPC1ATMALDH1A1HTTKDM4E | |
| SCHEMBL4301394 | 0.78 | KMT2A (0.46) | KMT2ANPC1RAB9AALDH1A1NPSR1 | |
| SCHEMBL4302849 | 0.76 | MCL1 (0.35) | NPC1ALDH1A1KDM4E | |
| SCHEMBL4306446 | 0.76 | CNR2 (0.39) | TP53BP1KMT2ANPC1RAB9AATM | |
| SCHEMBL4301396 | 0.75 | KMT2A (0.43) | KMT2ANPC1RAB9AALDH1A1NPSR1 | |
| SCHEMBL2808314 | 0.73 | ALDH1A1 (0.48) | KMT2ANPC1RAB9AALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009130231-A1 | PYRROLO [1, 2-A] PYRAZINE DERIVATIVES AS VASOPRESSIN VIB RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-10-29 | — | — | WO | disclosed |