Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.55 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.47 |
| ▸ | DPP4 | P27487 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL15317932 | 0.87 | KMT2A (0.51) | KMT2ANPC1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL19161083 | 0.85 | DPP4 (0.49) | KMT2ANPC1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL6349856 | 0.85 | DPP4 (0.49) | KMT2ANPC1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL1274533 | 0.84 | KMT2A (0.58) | KMT2ANPC1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL19520949 | 0.79 | TRPM8 (0.58) | KMT2AALDH1A1MEN1CYP3A4MAPT | |
| SCHEMBL16851474 | 0.79 | TRPM8 (0.58) | KMT2AALDH1A1MEN1CYP3A4MAPT | |
| SCHEMBL7424210 | 0.79 | TRPM8 (0.58) | KMT2AALDH1A1MEN1CYP3A4MAPT | |
| SCHEMBL30220325 | 0.79 | TRPM8 (0.58) | KMT2AALDH1A1MEN1CYP3A4MAPT | |
| SCHEMBL7424214 | 0.79 | TRPM8 (0.58) | KMT2AALDH1A1MEN1CYP3A4MAPT | |
| SCHEMBL19520951 | 0.79 | TRPM8 (0.58) | KMT2AALDH1A1MEN1CYP3A4MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023130008-A2 | PHARMACEUTICAL COMPOSITIONS OF 6-(2-(2H-TETRAZOL-5-YL)ETHYL)DECAHYDROISOQUINOLINE-3-CARBOXYLIC ACID AND DERIVATIVES THEREOF | SEA PHARMACEUTICALS LLC (US) | 2023-07-06 | — | — | WO | disclosed |