Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.41 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GPX4 | P36969 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PTGIR | P43119 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2808762 | 0.82 | ALDH1A1 (0.48) | ALDH1A1RAB9ANPC1PAX8JAK2 | |
| SCHEMBL9795610 | 0.82 | POLB (0.42) | FFAR1 | |
| SCHEMBL1120517 | 0.81 | ALDH1A1 (0.43) | ALDH1A1RAB9ANPC1PAX8JAK2 | |
| SCHEMBL19334460 | 0.81 | ALDH1A1 (0.47) | ALDH1A1RAB9ANPC1PAX8JAK2 | |
| SCHEMBL9135583 | 0.80 | RAB9A (0.50) | ALDH1A1RAB9ANPC1PAX8JAK2 | |
| SCHEMBL9780014 | 0.79 | PARP1 (0.42) | ALDH1A1PARP1PTGIR | |
| SCHEMBL9780057 | 0.79 | MTNR1A (0.44) | ALDH1A1PARP1FFAR1HPGD | |
| SCHEMBL11339632 | 0.79 | ALDH1A1 (0.49) | ALDH1A1RAB9ANPC1PAX8JAK2 | |
| SCHEMBL9779983 | 0.79 | HTR3E (0.44) | ALDH1A1RAB9AHTTPARP1TP53 | |
| SCHEMBL9779969 | 0.79 | SCN2A (0.39) | RAB9A |
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-5023255-A | Triazine derivatives; inhibitors exzyme 5-lipoxygenase | GLAXO GROUP LIMITED (GB) | 1991-06-11 | — | — | US | disclosed |
| US-4985427-A | LIPOXYGENASE INHIBITORS | GLAXO GROUP LIMITED (GB) | 1991-01-15 | — | — | US | disclosed |
| EP-0388165-A2 | Chemical compounds | GLAXO GROUP LIMITED (GB) | 1990-09-19 | — | — | EP | disclosed |
| EP-0340030-A2 | Triazine derivatives | GLAXO GROUP LIMITED (GB) | 1989-11-02 | — | — | EP | disclosed |