Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.40 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | FSHR | P23945 | 2/20 | 0.39 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.38 |
| ▸ | SSTR1 | P30872 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.38 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 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 | |
|---|---|---|---|---|
| SCHEMBL5161290 | 0.90 | SSTR4 (0.42) | MEN1ALDH1A1KMT2ATSHRSSTR1 | |
| SCHEMBL5160624 | 0.89 | LMNA (0.43) | HPGDSIGMAR1CACNA1GMEN1ALDH1A1 | |
| SCHEMBL205569 | 0.88 | ENPP2 (0.46) | EPHX2THRBHPGDSIGMAR1CACNA1G | |
| SCHEMBL206966 | 0.85 | EPHX2 (0.62) | EPHX2THRBHPGDSIGMAR1MEN1 | |
| SCHEMBL4081068 | 0.84 | THRB (0.39) | EPHX2THRBHPGDSIGMAR1CACNA1G | |
| Butane SCHEMBL4081062 | 0.83 | SIGMAR1 (0.39) | EPHX2THRBHPGDSIGMAR1CACNA1G | |
| SCHEMBL206084 | 0.83 | EPHX2 (0.47) | EPHX2THRBHPGDSIGMAR1SSTR1 | |
| SCHEMBL206772 | 0.82 | EPHX2 (0.47) | EPHX2THRBHPGDSIGMAR1ALDH1A1 | |
| SCHEMBL205735 | 0.82 | ALDH1A1 (0.55) | EPHX2THRBHPGDSIGMAR1MEN1 | |
| SCHEMBL206620 | 0.81 | EPHX2 (0.46) | EPHX2THRBHPGDSIGMAR1ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2007536323-A | — | — | 2007-12-13 | — | — | JP | claimed |
| EP-1745010-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2007-01-24 | — | — | EP | claimed |
| WO-2005110974-A1 | SUBSTITUTED CYCLOHEXYL-1,4-DIAMINE DERIVATIVES | Grünenthal GmbH (DE) | 2005-11-24 | — | — | WO | claimed |