Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 2/20 | 0.36 |
| ▸ | THRA | P10827 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.31 |
| ▸ | NAAA | Q02083 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL28268411 | 0.83 | CTSS (0.42) | EPHX1CTSSCTSKGAAALDH1A1 | |
| SCHEMBL28062228 | 0.83 | CTSS (0.42) | EPHX1CTSSCTSKGAAALDH1A1 | |
| SCHEMBL29006773 | 0.83 | CTSS (0.42) | EPHX1CTSSCTSKGAAALDH1A1 | |
| SCHEMBL28113226 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA | |
| SCHEMBL28291756 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA | |
| SCHEMBL28175176 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA | |
| SCHEMBL28856602 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA | |
| SCHEMBL28839099 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA | |
| SCHEMBL27627539 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA | |
| SCHEMBL28310174 | 0.82 | TSHR (0.35) | EPHX1CTSKTHRBTHRAGAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-102939290-B | 2,3-dihydro-1H-indenes-1-base-2,7-diaza spiro [3.5] nonane derivatives and as the antagonist of growth hormone-releasing peptide acceptor or the purposes of inverse agonist | PFIZER INC. (US) | 2015-09-16 | — | — | CN | disclosed |