Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 16/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 1/20 | 0.41 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.41 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.41 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL29803352 | 0.93 | PTPN11 (0.43) | PTPN11PTPN1NAMPTNPC1ALDH1A1 | |
| SCHEMBL29802997 | 0.88 | PTPN11 (0.39) | PTPN11PTPN1NAMPTMAPT | |
| SCHEMBL29803304 | 0.86 | HDAC2 (0.45) | NAMPTNPC1ALDH1A1ALOX15RAB9A | |
| SCHEMBL24671076 | 0.86 | PTPN11 (0.38) | PTPN11PTPN1NAMPT | |
| Hydrochloric Acid SCHEMBL29803300 | 0.85 | HDAC2 (0.44) | NAMPTNPC1ALDH1A1ALOX15RAB9A | |
| SCHEMBL29803084 | 0.83 | ESRRG (0.46) | PTPN11PTPN1NAMPTNPC1ALDH1A1 | |
| SCHEMBL24669181 | 0.82 | NAMPT (0.61) | PTPN1NAMPTSMN1; SMN2TSHRMAPT | |
| Trifluoroacetic Acid SCHEMBL29803396 | 0.81 | TRPV1 (0.38) | PTPN11PTPN1 | |
| SCHEMBL24667821 | 0.81 | TMPRSS2 (0.54) | NAMPTNPC1ALDH1A1ALOX15RAB9A | |
| SCHEMBL24669917 | 0.81 | ALDH1A1 (0.44) | NAMPTNPC1ALDH1A1ALOX15RAB9A |
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 | claimed |
| 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 |