Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | STAT6 | P42226 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ITK | Q08881 | 1/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL23320473 | 0.88 | CYP19A1 (0.41) | ALOX5MAPTCYP19A1KMT2AALDH1A1 | |
| SCHEMBL23320474 | 0.81 | PTGES2 (0.36) | ALOX5NTRK1 | |
| SCHEMBL23320498 | 0.81 | KCNA5 (0.37) | CA12CA9MAPTNPC1RAB9A | |
| SCHEMBL23320489 | 0.80 | CHEK1 (0.37) | PFKFB3ALDH1A1 | |
| SCHEMBL23320492 | 0.80 | CYP19A1 (0.40) | CA12CA9NPC1RAB9ANTRK1 | |
| SCHEMBL23320491 | 0.76 | ALDH1A1 (0.38) | ACLYALDH1A1LMNA | |
| SCHEMBL30943245 | 0.70 | CA12 (0.45) | CA12CA9MAPTNPC1RAB9A | |
| SCHEMBL23320494 | 0.70 | CA12 (0.45) | CA12CA9MAPTNPC1RAB9A | |
| SCHEMBL21534086 | 0.68 | KMT2A (0.56) | CA12CA9MAPTNPC1RAB9A | |
| SCHEMBL22004157 | 0.68 | ACLY (0.49) | CA12CA9MAPTNPC1RAB9A |
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-3818053-A1 | FUSED RING COMPOUND HAVING UREA STRUCTURE | Sanford Burnham Prebys Medical Discovery Institute (US) | 2021-05-12 | — | — | EP | disclosed |