Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28037912 | 0.85 | MAPT (0.40) | ALDH1A1HTTMAPTKMT2AMEN1 | |
| SCHEMBL28037916 | 0.85 | NPC1 (0.40) | ALDH1A1HTTMAPTKMT2AMEN1 | |
| SCHEMBL17707772 | 0.81 | CRHBP (0.46) | ALDH1A1MAPTKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL28012073 | 0.79 | ALDH1A1 (0.48) | ALDH1A1HTTMAPTSMN1; SMN2TSHR | |
| SCHEMBL28035660 | 0.72 | ALDH1A1 (0.38) | ALDH1A1HTTMAPTKMT2ASMN1; SMN2 | |
| SCHEMBL28320452 | 0.72 | KMT2A (0.53) | ALDH1A1HTTKMT2AMEN1TSHR | |
| SCHEMBL1161724 | 0.71 | TSHR (0.51) | ALDH1A1MAPTKMT2AMEN1TSHR | |
| SCHEMBL2140841 | 0.71 | MEN1 (0.49) | ALDH1A1MAPTKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL17707775 | 0.70 | TSHR (0.53) | ALDH1A1MAPTKMT2AMEN1SMN1; SMN2 | |
| SCHEMBL27523212 | 0.70 | GSK3B (0.51) | ALDH1A1HTTMAPTKMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105189447-A | Method for manufacturing nitrobenzene compound | IHARA CHEMICAL IND CO | 2015-12-23 | — | — | CN | disclosed |