Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 5/20 | 0.61 |
| ▸ | TP53 | P04637 | 4/20 | 0.61 |
| ▸ | NPC1 | O15118 | 4/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.60 |
| ▸ | MAPT | P10636 | 5/20 | 0.55 |
| ▸ | POLB | P06746 | 3/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.54 |
| ▸ | STAT1 | P42224 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.51 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4256379 | 0.90 | NPC1 (0.76) | ABCB1RAB9ATP53NPC1SMN1; SMN2 | |
| SCHEMBL24670914 | 0.86 | HTR1D (0.65) | ABCB1RAB9ATP53NPC1SMN1; SMN2 | |
| SCHEMBL29803730 | 0.85 | GRM4 (0.56) | RAB9ATP53NPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL24669380 | 0.85 | GRM4 (0.56) | RAB9ATP53NPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL24670802 | 0.85 | MAPT (0.67) | RAB9ATP53NPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL10035062 | 0.84 | ABCB1 (0.55) | ABCB1RAB9ATP53NPC1SMN1; SMN2 | |
| SCHEMBL24670251 | 0.83 | POLB (0.56) | ABCB1RAB9ANPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL24670265 | 0.83 | GRM4 (0.55) | RAB9ATP53NPC1SMN1; SMN2ALDH1A1 | |
| SCHEMBL24670737 | 0.83 | HTR1D (0.61) | ABCB1RAB9ATP53NPC1SMN1; SMN2 | |
| SCHEMBL29803389 | 0.83 | HTR1D (0.61) | ABCB1RAB9ATP53NPC1SMN1; SMN2 |
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 2 patents. 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 |
| 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 |