Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNN4 | O15554 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.43 |
| ▸ | SLC2A2 | P11168 | 2/20 | 0.43 |
| ▸ | SLC2A3 | P11169 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 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 | |
|---|---|---|---|---|
| SCHEMBL2095767 | 0.78 | KDM4E (0.59) | KCNN4ALDH1A1POLBMAPTNPC1 | |
| SCHEMBL11853749 | 0.77 | KCNMA1 (0.61) | KCNN4ALDH1A1HPGDCYP1A2MAPT | |
| SCHEMBL11843568 | 0.77 | RAB9A (0.41) | ALDH1A1MAPK1MAPTNPC1RAB9A | |
| SCHEMBL18181670 | 0.75 | KCNN4 (0.41) | KCNN4ALDH1A1CYP1A2SLC2A1SLC2A2 | |
| SCHEMBL11852236 | 0.73 | MAPT (0.46) | KCNN4POLBMAPTRAB9AKDM4E | |
| SCHEMBL11851657 | 0.73 | KDM4E (0.50) | ALDH1A1MAPK1HPGDMAPTNPC1 | |
| SCHEMBL798141 | 0.73 | FAAH (0.41) | NPC1RAB9ALMNA | |
| SCHEMBL13596807 | 0.72 | PDE4B (0.47) | ALDH1A1HPGDPOLBMAPTNPC1 | |
| SCHEMBL11855040 | 0.71 | PARP1 (0.41) | ALDH1A1MAPTNPC1RAB9AKDM4E | |
| SCHEMBL19920457 | 0.71 | NTSR1 (0.43) | KCNN4ALDH1A1SLC2A1SLC2A2SLC2A3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4000286-A | ANALGESICS, ANTIINFLAMMATORY AND ANTIPYRETIC AGENTS | MERCK & CO., INC. (US) | 1976-12-28 | — | — | US | disclosed |