Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR3 | P49682 | 1/20 | 0.52 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.49 |
| ▸ | SMO | Q99835 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL28099009 | 0.83 | CXCR3 (0.45) | CXCR3ADRA1AATMDRD2NOTUM | |
| SCHEMBL8434677 | 0.80 | MAOA (0.60) | CXCR3SLC18A3SMOADRA1ADRD2 | |
| SCHEMBL28286738 | 0.79 | SLC18A3 (0.61) | CXCR3SLC18A3SMO | |
| SCHEMBL6424174 | 0.78 | CXCR3 (0.62) | CXCR3SMODRD2 | |
| SCHEMBL28286732 | 0.78 | MEN1 (0.56) | MEN1KMT2ANOTUM | |
| SCHEMBL10263767 | 0.76 | SLC18A3 (0.67) | CXCR3SLC18A3SMO | |
| SCHEMBL27781945 | 0.75 | SLC18A3 (0.65) | CXCR3SLC18A3 | |
| SCHEMBL8259450 | 0.75 | HRH3 (0.50) | CXCR3SLC18A3SMOADRA1A | |
| SCHEMBL2925583 | 0.74 | ADRA1A (0.53) | SLC18A3ADRA1ANOTUM | |
| SCHEMBL22360347 | 0.73 | SLC18A3 (0.50) | CXCR3SLC18A3SMOADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| CN-105980374-A | Substituted piperidinyl-tetrahydroquinolines | 拜耳制药股份公司 | 2016-09-28 | — | — | CN | disclosed |