Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.39 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | FNTA | P49354 | 1/20 | 0.33 |
| ▸ | FNTB | P49356 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9840436 | 1.00 | NPSR1 (0.57) | NPSR1HCAR2GLO1CYP2C9ALDH1A1 | |
| SCHEMBL8976991 | 0.82 | NPSR1 (0.50) | NPSR1HCAR2GLO1CYP2C9TSHR | |
| SCHEMBL8976989 | 0.82 | NPSR1 (0.50) | NPSR1HCAR2GLO1CYP2C9TSHR | |
| SCHEMBL27447809 | 0.82 | NPSR1 (0.42) | NPSR1HCAR2GLO1CYP2C9ALDH1A1 | |
| SCHEMBL11720162 | 0.76 | NPSR1 (0.50) | NPSR1HCAR2GLO1ALDH1A1LMNA | |
| SCHEMBL11720173 | 0.76 | NPSR1 (0.50) | NPSR1HCAR2GLO1ALDH1A1LMNA | |
| SCHEMBL16683365 | 0.74 | HCAR2 (0.36) | NPSR1HCAR2LMNAMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL28082806 | 0.74 | NPSR1 (0.44) | NPSR1HCAR2GLO1ALDH1A1CYP2D6 | |
| SCHEMBL11143394 | 0.74 | NPSR1 (0.63) | NPSR1HCAR2GLO1CYP2C9ALDH1A1 | |
| SCHEMBL7770887 | 0.74 | NPSR1 (0.63) | NPSR1HCAR2GLO1CYP2C9ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5001254-A | Novel method for the preparation of quinoline-2,3-dicarboxylic | AMERICAN CYANAMID COMPANY | 1991-03-19 | — | — | US | disclosed |
| EP-0262305-B1 | METHOD FOR THE PREPARATION OF ANILINOFUMARATE AND QUINOLINE-2,3-DICARBOXYLIC ACID | AMERICAN CYANAMID COMPANY (US) | 1990-10-31 | — | — | EP | disclosed |
| US-4766218-A | CYCLIZATION OF DICHLOROSUCCINATE WITH AMINE | AMERICAN CYANAMID COMPANY (US) | 1988-08-23 | — | — | US | disclosed |
| EP-0262305-A1 | Method for the preparation of anilinofumarate and quinoline-2,3-dicarboxylic acid | AMERICAN CYANAMID COMPANY (US) | 1988-04-06 | — | — | EP | disclosed |