Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 5/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | TNF | P01375 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 5/20 | 0.39 |
| ▸ | CA9 | Q16790 | 5/20 | 0.39 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.39 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.39 |
| ▸ | SORD | Q00796 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | TDO2 | P48775 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9008978 | 0.95 | ALOX5 (0.61) | ALOX5NPC1TNFPOLBRAB9A | |
| SCHEMBL9008939 | 0.88 | ALOX5 (0.67) | ALOX5CA12CA9ALDH2AKR1B1 | |
| SCHEMBL9009222 | 0.87 | ALOX5 (0.61) | ALOX5NPC1TNFPOLBRAB9A | |
| SCHEMBL9008944 | 0.81 | ALOX5 (0.68) | ALOX5CA12CA9ALDH2AKR1B1 | |
| SCHEMBL2994964 | 0.81 | CA9 (0.51) | NPC1TNFPOLBRAB9ANOD1 | |
| SCHEMBL9008935 | 0.78 | ALOX5 (0.51) | ALOX5CA12CA9PGR | |
| SCHEMBL9008937 | 0.78 | ALOX5 (0.67) | ALOX5CA12CA9ALDH2AKR1B1 | |
| SCHEMBL9008954 | 0.77 | ALOX5 (0.59) | ALOX5CA12CA9ALDH2AKR1B1 | |
| SCHEMBL15215912 | 0.77 | ALOX5 (0.58) | ALOX5CA12CA9ALDH2AKR1B1 | |
| SCHEMBL2982477 | 0.74 | KCNA3 (0.44) | ALOX5NPC1TNFPOLBRAB9A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5576338-A | ANTIALLERGENS, ANTIHISTAMINES, ANTIINFLAMMATORY AGENTS AND CYTOPROTECTIVE AGENTS FOR CARDIOVASCULAR DISORDERS | MERCK FROSST CANADA, INC. (CA) | 1996-11-19 | — | — | US | claimed |
| US-5576338-A | ANTIALLERGENS, ANTIHISTAMINES, ANTIINFLAMMATORY AGENTS AND CYTOPROTECTIVE AGENTS FOR CARDIOVASCULAR DISORDERS | MERCK FROSST CANADA, INC. (CA) | 1996-11-19 | — | — | US | disclosed |