Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 6/20 | 0.53 |
| ▸ | CYP27A1 | Q02318 | 3/20 | 0.53 |
| ▸ | CYP26A1 | O43174 | 3/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | DRD2 | P14416 | 3/20 | 0.47 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | HTR2B | P41595 | 2/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.47 |
| ▸ | METAP1 | P53582 | 3/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.46 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7590204 | 0.87 | METAP1 (0.55) | CYP24A1CYP27A1CYP26A1CYP19A1HTR2A | |
| SCHEMBL13039619 | 0.81 | DRD2 (0.60) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL10341545 | 0.81 | CYP24A1 (0.61) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL6299794 | 0.80 | CYP24A1 (0.49) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL385632 | 0.80 | CYP19A1 (0.49) | CYP19A1DRD2HTR2CMTNR1AMTNR1B | |
| SCHEMBL7271049 | 0.80 | CYP24A1 (0.56) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL630841 | 0.80 | ACHE (0.58) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL2440274 | 0.79 | CYP24A1 (0.56) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL22867686 | 0.79 | CYP24A1 (0.55) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 | |
| SCHEMBL5753017 | 0.79 | CYP24A1 (0.55) | CYP24A1CYP27A1CYP26A1CYP19A1DRD2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-6256284-A | — | — | None | — | — | JP | disclosed |
| JP-H06256284-A | 2-CYANO-6-SUBSTITUTED-3,4-DHYDRO(OR 1,2,3,4-TETRAHYDRO) NAPHTHALENE DERIVATIVE, PRODUCTION THEREOF AND LIQUID CRYSTAL COMPOSITION COMPRISING THE SAME DERIVATIVE | TAKEDA CHEM IND LTD | 1994-09-13 | — | — | JP | disclosed |