Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 4/20 | 0.60 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | PKM | P14618 | 3/20 | 0.51 |
| ▸ | CD4 | P01730 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14751054 | 0.92 | AKR1C3 (0.65) | AKR1C3ESR2MEN1KMT2APKM | |
| SCHEMBL1949180 | 0.83 | PKM (0.54) | MEN1KMT2APKMSMN1; SMN2LMNA | |
| SCHEMBL15122772 | 0.83 | AKR1C3 (0.74) | AKR1C3SMN1; SMN2LMNA | |
| SCHEMBL20389408 | 0.81 | KMT2A (0.77) | AKR1C3ESR2MEN1KMT2ACYP3A4 | |
| SCHEMBL5632531 | 0.81 | AKR1C3 (0.60) | AKR1C3ESR2MEN1KMT2APKM | |
| SCHEMBL2590065 | 0.81 | AKR1C3 (0.60) | AKR1C3ESR2MEN1KMT2APKM | |
| SCHEMBL20910236 | 0.81 | CA7 (0.58) | AKR1C3ESR2MEN1KMT2APKM | |
| SCHEMBL15122441 | 0.79 | AKR1C3 (0.73) | AKR1C3SMN1; SMN2LMNA | |
| SCHEMBL13302259 | 0.79 | KMT2A (0.77) | AKR1C3MEN1KMT2APKMCYP3A4 | |
| SCHEMBL13102503 | 0.78 | ESR2 (0.69) | AKR1C3ESR2MEN1KMT2ACYP2C19 |
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-2018132372-A1 | SMALL MOLECULE ACTIVATORS OF NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE (NAMPT) AND USES THEREOF | Sanford Burnham Prebys Medical Discovery Institute (US) | 2018-07-19 | — | — | WO | disclosed |