Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 2/20 | 0.37 |
| ▸ | NAMPT | P43490 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL369224 | 0.77 | NAMPT (0.51) | LMNANAMPTMEN1KMT2AALDH1A1 | |
| SCHEMBL29078119 | 0.77 | DGAT1 (0.50) | KCNH2LMNAAPEX1PMP22ACACB | |
| Methyl Alcohol SCHEMBL29259257 | 0.76 | NAMPT (0.50) | LMNANAMPTMEN1KMT2AALDH1A1 | |
| SCHEMBL5246921 | 0.74 | ALDH1A1 (0.40) | KCNH2LMNAAPEX1PMP22ACACB | |
| SCHEMBL19143603 | 0.73 | — | — | |
| SCHEMBL28820761 | 0.72 | CYP2C19 (0.41) | ACACBALDH1A1DGAT1MAPTCYP2C9 | |
| SCHEMBL14683910 | 0.72 | DGAT1 (0.41) | LMNAALDH1A1DGAT1MAPTCYP2C9 | |
| SCHEMBL5162787 | 0.72 | KMT2A (0.53) | KCNH2ACACBNAMPTMEN1KMT2A | |
| SCHEMBL23655463 | 0.70 | — | — | |
| SCHEMBL3401677 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018132372-A1 | SMALL MOLECULE ACTIVATORS OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) AND USES THEREOF | Sanford Burnham Prebys Medical Discovery Institute (US) | 2018-07-19 | — | — | WO | disclosed |
| WO-2003076400-A1 | NEW INHIBITORS OF HISTONE DEACETYLASE | JANSSEN PHARMACEUTICA N.V. (BE) | 2003-09-18 | — | — | WO | disclosed |