Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.62 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.42 |
| ▸ | NCF1 | P14598 | 3/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL28670155 | 0.92 | ALDH1A1 (0.55) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL31376529 | 0.83 | ALDH1A1 (0.59) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL1848409 | 0.83 | ALDH1A1 (0.59) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL9295337 | 0.82 | ALDH1A1 (0.55) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL11303209 | 0.81 | ALDH1A1 (0.58) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL22288126 | 0.81 | ALDH1A1 (0.49) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL6798817 | 0.81 | ALDH1A1 (0.49) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL5336216 | 0.81 | ALDH1A1 (0.57) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL6281283 | 0.81 | ALDH1A1 (0.57) | ALDH1A1HSD17B10LMNACYP1A2TP53 | |
| SCHEMBL5974672 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HSD17B10LMNACYP1A2TP53 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105272930-B | Substituted urea derivative and its application in drug | 广东东阳光药业有限公司 | 2018-07-13 | — | — | CN | disclosed |
| EP-1453847-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | Ortho-Mcneil Pharmaceutical, Inc. (US) | 2004-09-08 | — | — | EP | disclosed |
| WO-2003050132-A1 | 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS | ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) | 2003-06-19 | — | — | WO | disclosed |
| US-5541196-A | ANTIPROTOZOA AGENTS | INSTITUT FRANCAIS DE RECHERCHE SCIENTIFIQUE POUR LE DEVELOPPMENT EN COOPERATION (ORSTOM) (FR) | 1996-07-30 | — | — | US | disclosed |