Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 11/20 | 0.64 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | TACR2 | P21452 | 1/20 | 0.46 |
| ▸ | RXRA | P19793 | 1/20 | 0.45 |
| ▸ | RXRB | P28702 | 1/20 | 0.45 |
| ▸ | RXRG | P48443 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 1/20 | 0.44 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.43 |
| ▸ | PTPN12 | Q05209 | 1/20 | 0.43 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL23496317 | 1.00 | PTPN1 (0.64) | PTPN1SMN1; SMN2RAB9ATACR2RXRA | |
| SCHEMBL23496328 | 0.86 | SMN1; SMN2 (0.53) | PTPN1SMN1; SMN2RAB9AALDH1A1MAOA | |
| SCHEMBL856364 | 0.85 | RXRA (0.59) | PTPN1TACR2RXRARXRBRXRG | |
| SCHEMBL23496281 | 0.84 | MRGPRX4 (0.54) | TACR2 | |
| SCHEMBL2930191 | 0.83 | RXRA (0.54) | PTPN1RXRARXRBRXRGALDH1A1 | |
| SCHEMBL8390016 | 0.83 | PTPN1 (0.48) | PTPN1TACR2RXRARXRBRXRG | |
| SCHEMBL5217355 | 0.83 | TACR2 (0.54) | PTPN1SMN1; SMN2TACR2RXRARXRB | |
| SCHEMBL856842 | 0.83 | ALDH1A1 (0.60) | SMN1; SMN2RAB9ATACR2ALDH1A1NPC1 | |
| SCHEMBL23496287 | 0.82 | ALDH1A1 (0.58) | PTPN1SMN1; SMN2RAB9ATACR2ALDH1A1 | |
| SCHEMBL28771925 | 0.82 | TACR2 (0.67) | PTPN1SMN1; SMN2RAB9ATACR2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4073048-A2 | SMALL MOLECULE INHIBITORS OF FUNGAL HYPHAE AND BIOFILM FORMATION | University of Sharjah (AE) | 2022-10-19 | — | — | EP | disclosed |