Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GRM4 | Q14833 | 5/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | WNT3A | P56704 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9476302 | 0.83 | HSD17B14 (0.46) | HSD17B14KMT2AALDH1A1MEN1GRM4 | |
| SCHEMBL8714874 | 0.80 | TLR7 (0.42) | HSD17B14KMT2AALDH1A1MEN1GRM4 | |
| SCHEMBL27490750 | 0.77 | KMT2A (0.53) | KMT2AALDH1A1MEN1RAB9AL3MBTL1 | |
| SCHEMBL9475963 | 0.77 | NPC1 (0.59) | HSD17B14KMT2AALDH1A1MEN1RAB9A | |
| SCHEMBL28337455 | 0.77 | GRM4 (0.60) | HSD17B14KMT2AALDH1A1MEN1GRM4 | |
| SCHEMBL3482032 | 0.76 | KMT2A (0.63) | KMT2AALDH1A1GRM4HDAC6RAB9A | |
| SCHEMBL28335130 | 0.76 | KMT2A (0.63) | KMT2AALDH1A1GRM4HDAC6RAB9A | |
| SCHEMBL17842464 | 0.75 | CTNNB1 (0.66) | HSD17B14KMT2AALDH1A1GRM4CTNNB1 | |
| SCHEMBL17842156 | 0.75 | GRM4 (0.64) | KMT2AALDH1A1MEN1GRM4RAB9A | |
| SCHEMBL30118935 | 0.73 | KMT2A (0.58) | HSD17B14KMT2AALDH1A1GRM4CTNNB1 |
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-5716971-A | FOR TREATMENT OF ANGINA PECTORIS AND HYPERTENSION | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-02-10 | — | — | US | disclosed |
| EP-0623597-B1 | Pyridine derivatives, with potassium channel opening activity | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1997-10-22 | — | — | EP | disclosed |
| EP-0623597-A1 | Pyridine derivatives, with potassium channel opening activity | Takeda Chemical Industries, Ltd. (JP) | 1994-11-09 | — | — | EP | disclosed |