Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.60 |
| ▸ | NAAA | Q02083 | 1/20 | 0.59 |
| ▸ | ESR1 | P03372 | 4/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.58 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.58 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.58 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.58 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11002289 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11001124 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11007001 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11010151 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11006084 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11005756 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11005721 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11000432 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11005679 | 1.00 | TSHR (0.63) | TSHRALDH1A1LMNATP53CYP3A4 | |
| SCHEMBL11004453 | 0.98 | TSHR (0.62) | TSHRALDH1A1LMNATP53CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0134576-A2 | Carbocyclic six-membered ring compounds | MERCK PATENT GmbH (DE) | 1985-03-20 | — | — | EP | disclosed |