Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | CASP1 | P29466 | 1/20 | 0.54 |
| ▸ | CASP7 | P55210 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.49 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.44 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6903284 | 0.90 | TSHR (0.58) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL8894839 | 0.90 | ALDH1A1 (0.62) | ALDH1A1KDM4EMAPTCASP1CASP7 | |
| SCHEMBL7255678 | 0.89 | HTT (0.62) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL15057855 | 0.86 | HTT (0.56) | ALDH1A1KDM4EHTTTSHRHPGD | |
| SCHEMBL8652703 | 0.85 | TSHR (0.53) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL2129167 | 0.85 | TSHR (0.47) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL1063005 | 0.84 | TSHR (0.66) | ALDH1A1KDM4EHTTTSHRHPGD | |
| SCHEMBL2080518 | 0.84 | TSHR (0.51) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL9516588 | 0.84 | TSHR (0.51) | ALDH1A1KDM4EMAPTHTTTSHR | |
| SCHEMBL9695573 | 0.83 | HTT (0.63) | ALDH1A1KDM4EMAPTCASP1CASP7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0406992-A2 | New non-ionic carboxamide contrast agent | SCHERING AKTIENGESELLSCHAFT (DE) | 1991-01-09 | — | — | EP | claimed |
| EP-0550008-A2 | Use of N-acyl derivatives of aminoalcohols with polycarboxylic acids for the manufacture of a medicament for the treatment of pathologies relating to mast cells | LIFEGROUP S.p.A. (IT) | 1993-07-07 | — | — | EP | disclosed |
| WO-1992001009-A1 | COMPOSITION CONTAINING ALKANOLAMINES AND POLYISOCYANATES | DSM N.V. (NL) | 1992-01-23 | — | — | WO | disclosed |