Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24670708 | 0.92 | MEN1 (0.55) | MEN1KMT2AADRB1USP2ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL29803292 | 0.91 | BACE1 (0.46) | SLC2A1KMT2AADRB1ALDH1A1BACE1 | |
| Trifluoroacetic Acid SCHEMBL29803995 | 0.91 | BACE1 (0.45) | SLC2A1MEN1KMT2AADRB1HDAC3 | |
| Trifluoroacetic Acid SCHEMBL29803841 | 0.88 | SLC2A1 (0.42) | SLC2A1MEN1KMT2AADRB1HDAC3 | |
| SCHEMBL29803340 | 0.82 | ADRB1 (0.54) | MEN1KMT2AADRB1ALDH1A1KDM4E | |
| Trifluoroacetic Acid SCHEMBL29803762 | 0.82 | RAB9A (0.56) | SLC2A1MEN1KMT2AUSP2ALDH1A1 | |
| SCHEMBL29803710 | 0.82 | MEN1 (0.50) | MEN1KMT2AADRB1USP2ALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL29803438 | 0.80 | SLC2A1 (0.54) | SLC2A1MEN1KMT2AUSP2ALDH1A1 | |
| SCHEMBL24669493 | 0.79 | HTR2A (0.43) | MEN1KMT2AADRB1HDAC3HTR2A | |
| SCHEMBL29803509 | 0.79 | HTR2A (0.43) | MEN1KMT2AADRB1HDAC3HTR2A |
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-2022192162-A1 | NOVEL HETEROAROMATIC COMPOUNDS EXHIBITING ANTIFUNGAL ACTIVITY AND THEIR METHOD OF USE | FOX CHASE CHEMICAL DIVERSITY CENTER, INC. (US) | 2022-09-15 | — | — | WO | disclosed |