Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.62 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MMP13 | P45452 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | STS | P08842 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6581249 | 0.87 | S1PR2 (0.56) | CYP2D6S1PR2KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL21819487 | 0.87 | KMT2A (0.64) | CYP2D6KMT2AMEN1SMN1; SMN2CYP2C19 | |
| SCHEMBL21819347 | 0.85 | GPR119 (0.55) | CYP2D6S1PR2KMT2AMEN1SMN1; SMN2 | |
| SCHEMBL3093877 | 0.82 | MEN1 (0.68) | S1PR2KMT2AMEN1 | |
| SCHEMBL194951 | 0.80 | CYP2D6 (0.72) | CYP2D6SMN1; SMN2CYP2C19HTTMAPT | |
| SCHEMBL4603719 | 0.80 | HDAC4 (0.63) | KMT2AMEN1MAPTPKMKDM4E | |
| SCHEMBL5752686 | 0.79 | HTR1A (0.60) | KMT2AMEN1 | |
| Water SCHEMBL3089403 | 0.79 | CYP2D6 (0.70) | CYP2D6SMN1; SMN2CYP2C19HTTMAPT | |
| SCHEMBL21819310 | 0.78 | KMT2A (0.54) | S1PR2KMT2AMEN1SMN1; SMN2HTT | |
| SCHEMBL17807228 | 0.78 | MAPT (0.62) | S1PR2KMT2AMEN1SMN1; SMN2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-6737425-B1 | SUCH AS 1-((4-CYANO-5-METHYL-4-PHENYL)HEXYL)-4-(2-(4-FLUORO -PHENOXY)ETHYL)PIPERAZINE; NERVE SELECTIVE CALCIUM ANTAGONISTS | EISAI CO., LTD. (JP) | 2004-05-18 | — | — | US | disclosed |