Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 4/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 2/20 | 0.33 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11533431 | 0.97 | HDAC3 (0.35) | KCNN4ALDH1A1ALOX15NPSR1HSD17B10 | |
| SCHEMBL11534104 | 0.91 | MAPT (0.36) | KCNN4ALDH1A1ALOX15NPSR1HSD17B10 | |
| SCHEMBL11534109 | 0.90 | ALDH1A1 (0.38) | ALDH1A1L3MBTL1GABRA1GABRG2GABRB3 | |
| SCHEMBL11542791 | 0.87 | MEN1 (0.39) | ALDH1A1L3MBTL1MAPK1GABRA1GABRG2 | |
| SCHEMBL11534846 | 0.87 | ALDH1A1 (0.39) | ALDH1A1GABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL11536526 | 0.87 | KMT2A (0.41) | ALDH1A1L3MBTL1MAPK1GABRA1GABRG2 | |
| SCHEMBL11541337 | 0.87 | MAPK1 (0.43) | ALDH1A1ALOX15L3MBTL1MAPK1GABRA1 | |
| SCHEMBL11538505 | 0.85 | GABRA1 (0.40) | ALDH1A1ALOX15HSD17B10GABRA1GABRG2 | |
| SCHEMBL11536196 | 0.84 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1GABRA1GABRG2GABRB3 | |
| SCHEMBL11536777 | 0.84 | ALDH1A1 (0.39) | ALDH1A1GABRA1GABRG2GABRB3GABRA5 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4139625-A | 5-(Substituted triphenylmethyl)picolinamides and their use as anti-acne agents | SCHERING CORPORATION (US) | 1979-02-13 | — | — | US | disclosed |
| US-4133887-A | Trityl picolinic acid derivatives and their use as anti-acne agents | SCHERING CORPORATION (US) | 1979-01-09 | — | — | US | disclosed |
| US-4127662-A | ANTIACNE | SCHERING CORPORATION (US) | 1978-11-28 | — | — | US | disclosed |
| US-4123433-A | ANTIACNE AGENTS | SCHERING CORPORATION (US) | 1978-10-31 | — | — | US | disclosed |
| US-4044140-A | Trityl picolinic acid derivatives and their use as anti-acne agents | SCHERING CORPORATION (US) | 1977-08-23 | — | — | US | disclosed |