Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9070790 | 0.92 | NAMPT (0.34) | NAMPTMEN1TP53TSHRHTT | |
| SCHEMBL2669769 | 0.88 | NAMPT (0.36) | NAMPTMEN1TP53TSHRHTT | |
| SCHEMBL2669895 | 0.87 | ESR1 (0.42) | MEN1TP53TSHRHTTKMT2A | |
| SCHEMBL2669960 | 0.86 | GCG (0.40) | NAMPTMEN1TP53TSHRHTT | |
| SCHEMBL13069831 | 0.85 | NPC1 (0.33) | MEN1TP53TSHRHTTKMT2A | |
| SCHEMBL2669896 | 0.85 | TP53 (0.42) | MEN1TP53KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL2669961 | 0.83 | MEN1 (0.35) | NAMPTMEN1TP53TSHRHTT | |
| SCHEMBL2669958 | 0.83 | CASP3 (0.39) | MEN1KMT2AALDH1A1 | |
| SCHEMBL2669939 | 0.83 | NPC1 (0.39) | — | |
| SCHEMBL2669959 | 0.83 | SRC (0.33) | NAMPTMEN1TP53TSHRHTT |
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-2009110520-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-09-11 | — | — | WO | disclosed |