Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.49 |
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | ATRIP | Q8WXE1 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | POLB | P06746 | 3/20 | 0.39 |
| ▸ | CASP3 | P42574 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.36 |
| ▸ | GABRA2 | P47869 | 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 | |
|---|---|---|---|---|
| SCHEMBL1367212 | 0.84 | ROCK2 (0.40) | GPR119ATRATRIPPOLBCASP3 | |
| SCHEMBL16824339 | 0.84 | ROCK2 (0.40) | GPR119ATRATRIPPOLBCASP3 | |
| SCHEMBL16824342 | 0.82 | CASP3 (0.38) | GPR119ATRATRIPCASP3ROCK2 | |
| SCHEMBL28282199 | 0.82 | GPR119 (0.45) | GPR119KDM4EPOLBSMN1; SMN2GAA | |
| SCHEMBL10209181 | 0.81 | SMN1; SMN2 (0.46) | GPR119ATRATRIPKDM4EPOLB | |
| SCHEMBL16827286 | 0.80 | MEN1 (0.42) | GPR119ATRATRIPPOLBSMN1; SMN2 | |
| SCHEMBL7960845 | 0.80 | MEN1 (0.42) | GPR119ATRATRIPPOLBSMN1; SMN2 | |
| SCHEMBL17988742 | 0.80 | MEN1 (0.42) | GPR119ATRATRIPPOLBSMN1; SMN2 | |
| SCHEMBL10209180 | 0.79 | SMN1; SMN2 (0.47) | GPR119ATRATRIPKDM4EPOLB | |
| SCHEMBL9105161 | 0.77 | SMN1; SMN2 (0.58) | KDM4EPOLBSMN1; SMN2TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106458978-B | Substituted piperidinyl tetrahydroquinolines and their use as α -2C adrenergic receptor antagonists | 拜耳制药股份公司 | 2019-06-28 | — | — | CN | disclosed |
| CN-106458978-A | Substituted piperidinyl tetrahydroquinolines and their use as alpha-2C adrenergic receptor antagonists | 拜耳制药股份公司 | 2017-02-22 | — | — | CN | disclosed |