Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | RGS12 | O14924 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | HPRT1 | P00492 | 1/20 | 0.32 |
| ▸ | PNP | P00491 | 1/20 | 0.31 |
| ▸ | TYMS | P04818 | 3/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | XDH | P47989 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9543219 | 0.81 | PNP (0.33) | KDM4EMEN1RGS12LMNACYP3A4 | |
| SCHEMBL9543827 | 0.77 | DHFR (0.34) | MEN1KMT2AHPRT1PNPTYMS | |
| SCHEMBL9544423 | 0.74 | HSD17B10 (0.33) | KDM4EHSD17B10HPRT1PNPDHFR | |
| Hydrochloric Acid SCHEMBL9544734 | 0.74 | DHFR (0.35) | HPRT1PNPTYMSDHFR | |
| SCHEMBL9544073 | 0.71 | NPSR1 (0.37) | MEN1KMT2AHIF1AALDH1A1HPRT1 | |
| SCHEMBL25638671 | 0.69 | HPRT1 (0.44) | KDM4EMEN1RGS12LMNACYP3A4 | |
| SCHEMBL9544019 | 0.65 | PNP (0.36) | KDM4ELMNAHSD17B10ALDH1A1PNP | |
| SCHEMBL676634 | 0.63 | KDM4E (0.43) | KDM4EMEN1RGS12LMNACYP3A4 | |
| SCHEMBL8133897 | 0.63 | NOS1 (0.33) | KDM4ELMNAHSD17B10ALDH1A1PNP | |
| SCHEMBL20968806 | 0.61 | PNP (0.38) | HPRT1PNPXDH |
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-1993020075-A1 | 8-SUBSTITUTED-N5-DEAZAPTERINS AS ANTIFOLATES | THE UNIVERSITY OF SYDNEY (AU) | 1993-10-14 | — | — | WO | disclosed |