Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHODH | Q02127 | 3/20 | 0.44 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 2/20 | 0.41 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.39 |
| ▸ | CNR1 | P21554 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 2/20 | 0.36 |
| ▸ | CTSA | P10619 | 1/20 | 0.36 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL20118174 | 0.82 | CRHR1 (0.40) | DHODHSMYD3GRM5ACKR3PDE4B | |
| SCHEMBL20118167 | 0.75 | SHMT2 (0.42) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL20118158 | 0.75 | SHMT2 (0.42) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL20118157 | 0.73 | SHMT2 (0.42) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL20118131 | 0.70 | SHMT2 (0.46) | KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL20118216 | 0.69 | L3MBTL1 (0.40) | KDM4EHPGDHSD17B10ALDH1A1KMT2A | |
| SCHEMBL20118195 | 0.68 | HSD11B1 (0.44) | PDE4BPDE4DRIPK1NTRK1 | |
| SCHEMBL20118414 | 0.67 | TNKS (0.55) | KDM4EHSD17B10 | |
| SCHEMBL20118215 | 0.67 | ITGB1 (0.34) | MEN1KMT2A | |
| SCHEMBL20118187 | 0.65 | PDE4B (0.41) | CNR1CNR2PDE4BPDE4DHPGD |
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-2018078009-A1 | AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |