Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.50 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 5/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.38 |
| ▸ | S100A4 | P26447 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10361232 | 0.84 | TAS1R3 (0.57) | TAS1R3TAS1R1CRHR1CYP2A6ALDH1A1 | |
| SCHEMBL701970 | 0.84 | TAS1R3 (0.50) | TAS1R3TAS1R1ALDH1A1L3MBTL1MAPT | |
| SCHEMBL30219271 | 0.82 | AR (0.50) | TAS1R3TAS1R1MAPTTDP1 | |
| SCHEMBL8606616 | 0.82 | TAS1R3 (0.49) | TAS1R3TAS1R1CRHR1ALDH1A1HPGD | |
| SCHEMBL1545562 | 0.80 | PKM (0.52) | CRHR1CYP2A6ALDH1A1HPGDLMNA | |
| SCHEMBL21374189 | 0.79 | ALDH1A1 (0.57) | TAS1R3TAS1R1ALDH1A1HPGDLMNA | |
| SCHEMBL9548058 | 0.78 | GSK3B (0.52) | TAS1R3TAS1R1L3MBTL1KMT2A | |
| SCHEMBL29787835 | 0.76 | SMN1; SMN2 (0.57) | CYP2A6ALDH1A1HPGDLMNARAB9A | |
| SCHEMBL110321 | 0.76 | SMN1; SMN2 (0.57) | CYP2A6ALDH1A1HPGDLMNARAB9A | |
| SCHEMBL10804813 | 0.76 | ALDH1A1 (0.51) | ALDH1A1HPGDLMNAL3MBTL1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5198587-A | Adrenergic Blocking Agents, Hypotensive Agents | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1993-03-30 | — | — | US | disclosed |
| US-5063246-A | Hypotensive | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1991-11-05 | — | — | US | disclosed |
| US-4880841-A | ADRENERGIC BLOCKING AGENTS, HYPOTENSIVE AGENTS | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) | 1989-11-14 | — | — | US | disclosed |