Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | CDK9 | P50750 | 3/20 | 0.36 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.33 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL24669395 | 0.91 | NR1H2 (0.39) | NR1H2CDK9CCNT1PDK4JAK1 | |
| SCHEMBL24671139 | 0.87 | NR1H2 (0.40) | NR1H2CDK9PDK4JAK1NAMPT | |
| SCHEMBL24670136 | 0.87 | NR1H2 (0.40) | NR1H2CDK9PDK4JAK1NAMPT | |
| SCHEMBL24670618 | 0.86 | NR1H2 (0.39) | NR1H2CDK9PDK4JAK1NAMPT | |
| SCHEMBL24671224 | 0.86 | NR1H2 (0.39) | NR1H2CDK9CCNT1PDK4JAK1 | |
| SCHEMBL24670675 | 0.84 | NR1H2 (0.38) | NR1H2CDK9PDK4JAK1NAMPT | |
| SCHEMBL24669443 | 0.82 | KCNQ3 (0.38) | CDK9CCNT1NAMPTMAPTTRPV1 | |
| SCHEMBL24669449 | 0.82 | KCNQ3 (0.38) | CDK9CCNT1NAMPTMAPTTRPV1 | |
| SCHEMBL24669345 | 0.80 | PDK4 (0.40) | CDK9PDK4JAK1NAMPTMAPT | |
| SCHEMBL24670250 | 0.80 | GRM1 (0.36) | NR1H2CDK9CCNT1PDK4JAK1 |
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 |