Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 6/20 | 0.39 |
| ▸ | THRA | P10827 | 5/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5858136 | 0.83 | THRB (0.39) | AKR1C3AKR1C2THRBTHRALMNA | |
| SCHEMBL5858325 | 0.80 | THRB (0.49) | THRBTHRAMEN1KMT2ANPSR1 | |
| SCHEMBL1939457 | 0.77 | AKR1C3 (0.54) | AKR1C3AKR1C2CA1CA2MAPT | |
| SCHEMBL7112160 | 0.75 | BACE1 (0.52) | MAPTMEN1KMT2ANPSR1LMNA | |
| SCHEMBL5859452 | 0.75 | THRB (0.62) | AKR1C3AKR1C2THRBTHRA | |
| SCHEMBL5858288 | 0.73 | PTGS2 (0.54) | AKR1C3AKR1C2THRBTHRANPBWR1 | |
| SCHEMBL4874926 | 0.73 | HSD17B10 (0.40) | AKR1C3AKR1C2CA1CA2MAPT | |
| SCHEMBL1413280 | 0.73 | AKR1C3 (0.58) | AKR1C3AKR1C2CA1CA2KMT2A | |
| SCHEMBL5859480 | 0.72 | THRA (0.64) | THRBTHRAMAPK1 | |
| SCHEMBL25166842 | 0.72 | KDM4E (0.41) | AKR1C3AKR1C2CA1CA2MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7144909-B2 | Phenoxy substituted benzocondensed heteroaryl derivatives as thyroid receptor ligands | KARO BIO AB (SE) | 2006-12-05 | — | — | US | disclosed |
| US-20040116387-A1 | Phenoxy substituted benzocondensed heteroaryl derivatives as thyroid receptor ligands | KARO BIO AB (SE) | 2004-06-17 | — | — | US | disclosed |