Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL429150 | 0.87 | ALDH1A1 (0.42) | TSHRALDH1A1L3MBTL1CYP3A4MAPT | |
| SCHEMBL13412750 | 0.82 | ALDH1A1 (0.50) | TSHRPABPC1KEAP1NFE2L2ALDH1A1 | |
| SCHEMBL4776892 | 0.81 | KEAP1 (0.52) | TSHRPTGS2KEAP1NFE2L2ALDH1A1 | |
| SCHEMBL225741 | 0.80 | NPC1 (0.50) | TSHRPABPC1ALDH1A1NPC1RAB9A | |
| SCHEMBL9800976 | 0.80 | NPC1 (0.50) | TSHRPABPC1ALDH1A1NPC1RAB9A | |
| SCHEMBL11409022 | 0.78 | NPC1 (0.48) | TSHRPABPC1ALDH1A1NPC1RAB9A | |
| SCHEMBL5514299 | 0.78 | TSHR (0.44) | TSHRPABPC1PTGS2KEAP1NFE2L2 | |
| SCHEMBL9685869 | 0.78 | TSHR (0.38) | TSHRPABPC1PTGS2KEAP1NFE2L2 | |
| SCHEMBL7528740 | 0.78 | GAA (0.46) | PTGS2ALDH1A1RAPGEF4L3MBTL1MAPT | |
| SCHEMBL7123694 | 0.78 | LMNA (0.40) | TSHRPABPC1PTGS2KEAP1NFE2L2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5041670-A | Preparation of n-aryl amines from isocyanates | DREXEL UNIVERSITY (US) | 1991-08-20 | — | — | US | disclosed |