Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | F2 | P00734 | 3/20 | 0.48 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.48 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.48 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | EDNRA | P25101 | 10/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | NSD2 | O96028 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL29550086 | 0.86 | CA2 (0.55) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL563863 | 0.81 | CA2 (0.69) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL27613656 | 0.78 | CA2 (0.64) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL18669851 | 0.77 | CA2 (0.63) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL17294738 | 0.77 | CA2 (0.55) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL11127453 | 0.75 | CA2 (0.64) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL870151 | 0.73 | CA2 (0.54) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL9019311 | 0.73 | CA2 (0.71) | CA2CYP1A2CYP2C19HTTHIF1A | |
| SCHEMBL1131010 | 0.73 | CA2 (0.71) | CA2CYP1A2CYP2C19HTTHIF1A | |
| Nitrogen SCHEMBL2132642 | 0.72 | CA2 (0.65) | CA2CYP1A2CYP2C19HTTHIF1A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0781753-B1 | Enantiometric resolution of 4-(3,4-dichlorophenyl)-3, 4-dihydro-1(2H)-naphthalenone | PFIZER (US) | 1999-03-31 | — | — | EP | disclosed |
| EP-0616996-B1 | Enantiomeric resolution of 4-(3,4-dichlorophenyl)-3,4-dihydro-1(2H)-Naphthalenone | PFIZER (US) | 1997-07-30 | — | — | EP | disclosed |
| EP-0781753-A1 | Enantiometric resolution of 4-(3,4-dichlorophenyl)-3, 4-dihydro-1 (2H)-naphthalenone | PFIZER INC. (US) | 1997-07-02 | — | — | EP | disclosed |
| EP-0616996-A1 | Enantiomeric resolution of 4-(3,4-dichlorophenyl)-3,4-dihydro-1(2H)-Naphthalenone | PFIZER INC. (US) | 1994-09-28 | — | — | EP | disclosed |
| US-5288916-A | Contacting with liquid mixture of water and solvent containing cyclodextrin binder which selectively binds one enantiomer | BEND RESEARCH, INC. (US) | 1994-02-22 | — | — | US | disclosed |