Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | TACR1 | P25103 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | GRN | P28799 | 1/20 | 0.33 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.33 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.32 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.32 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.32 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5367786 | 0.76 | TSHR (0.39) | TSHRALDH1A1KDM4EGAAHPGD | |
| SCHEMBL3900724 | 0.70 | PTGS1 (0.43) | ALDH1A1KDM4EHPGDMAPTPOLB | |
| SCHEMBL19584627 | 0.69 | NR1H2 (0.44) | TSHRKDM4EGAAHPGDHTR2C | |
| SCHEMBL5363641 | 0.67 | TSHR (0.40) | TSHRALDH1A1KDM4EHTR2CSLC6A4 | |
| SCHEMBL15701583 | 0.64 | PTGS2 (0.45) | KDM4EGAAHPGDGRNSORT1 | |
| SCHEMBL5464352 | 0.64 | TSHR (0.40) | TSHRALDH1A1HTR2CSLC6A4HTR2A | |
| SCHEMBL8157722 | 0.62 | ALDH1A1 (0.61) | TSHRALDH1A1KDM4ETACR1POLB | |
| SCHEMBL2226540 | 0.62 | SLC16A3 (0.56) | ALDH1A1KDM4EGAAMAPTGRN | |
| Bromoethane SCHEMBL20577437 | 0.62 | TSHR (0.75) | TSHRALDH1A1KDM4ETACR1MAPT | |
| SCHEMBL14061138 | 0.61 | SMN1; SMN2 (0.46) | TSHRALDH1A1KDM4EGAAMAPT |
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-2007145349-A2 | SUBSTITUTED PYRROLE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-12-21 | — | — | WO | disclosed |