Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S100A4 | P26447 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 10/20 | 0.44 |
| ▸ | NPC1 | O15118 | 4/20 | 0.44 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | GRM5 | P41594 | 2/20 | 0.41 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | GALR2 | O43603 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6916314 | 0.83 | S100A4 (0.46) | S100A4TRPV1MAPTALDH1A1SMN1; SMN2 | |
| SCHEMBL13813006 | 0.82 | CTSB (0.47) | S100A4TRPV1MAPTNPC1RAB9A | |
| SCHEMBL29430825 | 0.78 | S100A4 (0.46) | S100A4TRPV1MAPTNPC1RAB9A | |
| SCHEMBL22636651 | 0.78 | S100A4 (0.46) | S100A4TRPV1MAPTNPC1RAB9A | |
| SCHEMBL1359386 | 0.78 | ALDH1A1 (0.43) | S100A4TRPV1MAPTMEN1KMT2A | |
| SCHEMBL6916316 | 0.75 | KMT2A (0.53) | MAPTNPC1RAB9AMEN1KMT2A | |
| SCHEMBL4150422 | 0.72 | PDE10A (0.53) | S100A4MAPTNPC1RAB9AMEN1 | |
| SCHEMBL30117516 | 0.72 | PDE10A (0.53) | S100A4MAPTNPC1RAB9AMEN1 | |
| SCHEMBL28697427 | 0.71 | MEN1 (0.42) | MAPTNPC1RAB9AGRM5MEN1 | |
| SCHEMBL444702 | 0.71 | ALDH1A1 (0.53) | S100A4MAPTNPC1RAB9AGRM5 |
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-2229379-A2 | SOLID FORMS OF 1-ETHYL-3-(5-(5-FLUOROPYRIDIN-3-YL)-7-(PYRIMIDIN-2-YL)-1H-BENZO[D]IMIDAZOL-2-YL)UREA | Vertex Pharmaceuticals Incorporated (US) | 2010-09-22 | — | — | EP | disclosed |
| WO-2009076200-A2 | SOLID FORMS OF 1-ETHYL-3-(5-(5-FLUOROPYRIDIN-3-YL)-7-(PYRIMIDIN-2-YL)-1H-BENZO[D]IMIDAZOL-2-YL)UREA | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2009-06-18 | — | — | WO | disclosed |