Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 1/20 | 0.40 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.40 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HTR5A | P47898 | 5/20 | 0.35 |
| ▸ | HTR1A | P08908 | 3/20 | 0.35 |
| ▸ | HTR1D | P28221 | 3/20 | 0.35 |
| ▸ | HTR2C | P28335 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1773148 | 0.79 | MEN1 (0.40) | MEN1KMT2AUSP2PPARGKEAP1 | |
| SCHEMBL1773151 | 0.79 | MEN1 (0.40) | MEN1KMT2AUSP2PPARGKEAP1 | |
| SCHEMBL5259226 | 0.79 | KMT2A (0.40) | MEN1KMT2AUSP2PPARGKEAP1 | |
| SCHEMBL8203048 | 0.76 | MEN1 (0.38) | MEN1KMT2AUSP2PPARGKEAP1 | |
| SCHEMBL309794 | 0.71 | MAPT (0.50) | MEN1KMT2AUSP2PPARGKEAP1 | |
| SCHEMBL5445017 | 0.71 | CHRM1 (0.49) | MEN1KMT2AUSP2HSD17B10SMN1; SMN2 | |
| SCHEMBL311435 | 0.70 | TRPA1 (0.55) | MEN1KMT2ASMN1; SMN2MAPTTP53 | |
| SCHEMBL6029951 | 0.69 | HTR1A (0.44) | HSD17B10ALDH1A1KDM4EHTR5AHTR1A | |
| SCHEMBL1132587 | 0.69 | TRPA1 (0.40) | MEN1KMT2AUSP2PPARGKEAP1 | |
| SCHEMBL1726796 | 0.69 | TRPA1 (0.56) | HTR1AHTR2CHTR2AHTR3AHRH1 |
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-2011123678-A2 | SUBSTITUTED BENZO-PYRIDO-TRIAZOLO-DIAZEPINE COMPOUNDS | ARQULE, INC. (US) | 2011-10-06 | — | — | WO | disclosed |