Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | SYK | P43405 | 2/20 | 0.44 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.43 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL19790567 | 0.77 | NOTUM (0.42) | NOTUMSYKCACNA1HMAOAMAOB | |
| SCHEMBL5344229 | 0.73 | NOTUM (0.43) | NOTUMNPC1RAB9ASYKCACNA1H | |
| SCHEMBL5344232 | 0.73 | NOTUM (0.43) | NOTUMNPC1RAB9ASYKCACNA1H | |
| SCHEMBL31036105 | 0.72 | NOTUM (0.61) | NOTUMKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL20423953 | 0.72 | RECQL (0.54) | MEN1KMT2AALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL3438334 | 0.72 | HCAR3 (0.56) | KDM4EMEN1KMT2AALDH1A1MAPT | |
| SCHEMBL20594117 | 0.71 | KDM4E (0.54) | KDM4EMEN1KMT2AALDH1A1CACNA1H | |
| SCHEMBL30147500 | 0.71 | MAOB (0.48) | CACNA1HMAOAMAOBMLLT1 | |
| SCHEMBL11546804 | 0.71 | KDM4E (0.62) | KDM4EMEN1KMT2AALDH1A1CYP1A2 | |
| SCHEMBL250286 | 0.70 | HTR2A (0.49) | KDM4EMEN1KMT2AALDH1A1CACNA1H |
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-2018115383-A1 | BICYCLIC DIHYDROPYRIMIDINE-CARBOXAMIDE DERIVATIVES AS RHO-KINASE INHIBITORS | CHIESI FARMACEUTICI S.P.A. (IT) | 2018-06-28 | — | — | WO | disclosed |