Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 5/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.33 |
| ▸ | LDHA | P00338 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11524789 | 0.84 | PDK1 (0.32) | RAB9ANPC1ALOX5 | |
| SCHEMBL11306176 | 0.84 | LDHA (0.41) | HTR2ASLC6A4KCNH2ACACBLDHA | |
| SCHEMBL11457464 | 0.82 | LDHA (0.48) | ACACBLDHAIDO1 | |
| SCHEMBL11530957 | 0.72 | NFE2L2 (0.40) | — | |
| SCHEMBL11530952 | 0.72 | NFE2L2 (0.40) | — | |
| SCHEMBL11531573 | 0.72 | NPC1 (0.49) | RAB9ANPC1ACACB | |
| SCHEMBL11477187 | 0.70 | HTR1A (0.44) | HTR2ASLC6A4RAB9ANPC1 | |
| SCHEMBL11528965 | 0.69 | MDM2 (0.37) | RAB9ANPC1 | |
| SCHEMBL8340513 | 0.69 | SLC6A4 (0.47) | HTR2ASLC6A4KCNH2IDO1 | |
| SCHEMBL11528286 | 0.68 | MRGPRX4 (0.55) | RAB9ANPC1LDHA |
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-4171371-A | Diketones | STERLING DRUG INC. (US) | 1979-10-16 | — | — | US | disclosed |
| US-4153719-A | Aromatic diketones | STERLING DRUG INC. (US) | 1979-05-08 | — | — | US | disclosed |