Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.81 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.81 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.81 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.81 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.64 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.64 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.64 |
| ▸ | ATM | Q13315 | 2/20 | 0.64 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.64 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.64 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.64 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.64 |
| ▸ | PGR | P06401 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL819163 | 0.90 | TSHR (1.00) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| SCHEMBL8598002 | 0.87 | TSHR (0.58) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| SCHEMBL1573848 | 0.80 | IDO1 (0.56) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| SCHEMBL18675614 | 0.79 | TSHR (0.50) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| SCHEMBL18675613 | 0.79 | TSHR (0.50) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| SCHEMBL11279371 | 0.79 | TSHR (0.50) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| SCHEMBL683676 | 0.79 | TSHR (0.50) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| Mitotane SCHEMBL29360948 | 0.79 | TSHR (1.00) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| Mitotane SCHEMBL2352082 | 0.79 | TSHR (1.00) | TSHRTDP1HIF1AMAPK1SLC6A2 | |
| Mitotane SCHEMBL4040 | 0.79 | TSHR (1.00) | TSHRTDP1HIF1AMAPK1SLC6A2 |
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-2230312-A1 | Probe compound for detecting and isolating enzymes and means and methods using the same | Helmholtz-Zentrum für Infektionsforschung GmbH (DE) | 2010-09-22 | — | — | EP | disclosed |