Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.69 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | F2 | P00734 | 1/20 | 0.53 |
| ▸ | PLG | P00747 | 1/20 | 0.53 |
| ▸ | ELANE | P08246 | 1/20 | 0.53 |
| ▸ | CTSG | P08311 | 1/20 | 0.53 |
| ▸ | CMA1 | P23946 | 1/20 | 0.53 |
| ▸ | CTRC | Q99895 | 1/20 | 0.53 |
| ▸ | GSK3A | P49840 | 2/20 | 0.51 |
| ▸ | GSK3B | P49841 | 2/20 | 0.51 |
| ▸ | EP300 | Q09472 | 2/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.50 |
| ▸ | ACHE | P22303 | 1/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | MT-CO2 | P00403 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL584720 | 1.00 | ALDH1A1 (0.69) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1749140 | 0.98 | ALDH1A1 (0.67) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1749922 | 0.98 | ALDH1A1 (0.67) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL651980 | 0.89 | ALDH1A1 (0.69) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL13783795 | 0.85 | ALDH1A1 (0.73) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL1023519 | 0.85 | ALDH1A1 (0.73) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL12372537 | 0.85 | ALDH1A1 (0.73) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL8572187 | 0.82 | MT-CO2 (0.54) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL8383162 | 0.81 | ALDH1A1 (1.00) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL6747735 | 0.81 | ALDH1A1 (1.00) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020100011-A1 | IMPROVED SYNTHETIC METHODS OF MAKING FUSED HETEROCYCLIC COMPOUNDS AS OREXIN RECEPTOR MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2020-05-22 | — | — | WO | disclosed |
| EP-1732546-A2 | NOVEL PYRROLO (2,3-B)PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS | Aventis Pharma S.A. (FR) | 2006-12-20 | — | — | EP | disclosed |
| WO-2005095399-A2 | NOVEL PYRROLO (2,3-B)PYRIDINE DERIVATIVES, THE PREPARATION AND THE PHARMACEUTICAL USE THEREOF IN THE FORM OF KINASE INHIBITORS | AVENTIS PHARMA S.A. (FR) | 2005-10-13 | — | — | WO | disclosed |