Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | PPP1R15A | O75807 | 1/20 | 0.42 |
| ▸ | MELK | Q14680 | 1/20 | 0.42 |
| ▸ | PPP1R15B | Q5SWA1 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL30011286 | 0.93 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL95211 | 0.93 | ALDH1A1 (0.54) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| Hydrochloric Acid SCHEMBL28994838 | 0.91 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| Hydrochloric Acid SCHEMBL29009133 | 0.91 | ALDH1A1 (0.52) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL3794351 | 0.81 | TDP1 (0.58) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL7009789 | 0.77 | ALDH1A1 (0.53) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL15653257 | 0.77 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL2475165 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL223411 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1TDP1LMNA | |
| SCHEMBL30234436 | 0.76 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1TDP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-101557810-B | Novel 2 -imidazoles as ligands for trace amine associated receptors (taar) | HOFFMANN LA ROCHE | 2012-11-21 | — | — | CN | disclosed |
| CN-101557810-A | Novel 2 -imidazoles as ligands for trace amine associated receptors (taar) | HOFFMANN LA ROCHE (CH) | 2009-10-14 | — | — | CN | disclosed |