Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTNR1A | P48039 | 1/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.45 |
| ▸ | ABCC3 | O15438 | 1/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.45 |
| ▸ | ABCC8 | Q09428 | 1/20 | 0.45 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.45 |
| ▸ | ABCC2 | Q92887 | 1/20 | 0.45 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6471980 | 0.87 | TDP1 (0.44) | MTNR1AMTNR1BCYP3A4LMNASLC22A1 | |
| SCHEMBL3225523 | 0.83 | TSHR (0.51) | CYP3A4LMNASLC22A1ABCC3ABCC4 | |
| SCHEMBL7791924 | 0.79 | TSHR (0.51) | CYP3A4LMNASLC22A1ABCC3ABCC4 | |
| SCHEMBL28629032 | 0.79 | ALDH1A1 (0.47) | MTNR1AMTNR1BCYP3A4KDM4ETSHR | |
| SCHEMBL26102140 | 0.78 | MTNR1A (0.56) | MTNR1AMTNR1BCYP3A4LMNAKDM4E | |
| SCHEMBL31135570 | 0.78 | MTNR1A (0.56) | MTNR1AMTNR1BCYP3A4LMNAKDM4E | |
| SCHEMBL7605944 | 0.77 | TSHR (0.53) | CYP3A4LMNASLC22A1ABCC3ABCC4 | |
| SCHEMBL4005109 | 0.77 | FOLH1 (0.52) | CYP3A4LMNASLC22A1ABCC3ABCC4 | |
| SCHEMBL5473946 | 0.76 | MEN1 (0.48) | MTNR1AMTNR1BKDM4ETSHRKMT2A | |
| Hydrochloric Acid SCHEMBL8574910 | 0.76 | TSHR (0.47) | CYP3A4LMNASLC22A1ABCC3ABCC4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005019140-A1 | ETHYL 4-(2-TERT-BUTOXY-2-OXOETHYL)-2-ETHOXYBENZOATE, INTERMEDIATE FOR THE PREPARATION OF REPAGLINIDE | BIOCON LIMITED (IN) | 2005-03-03 | — | — | WO | disclosed |