Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.35 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.31 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.31 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL868326 | 0.80 | KDM4E (0.49) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8131234 | 0.78 | ALDH1A1 (0.48) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8117996 | 0.78 | KDM4E (0.47) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8126943 | 0.78 | KDM4E (0.41) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8127031 | 0.78 | ALDH1A1 (0.52) | GAAKDM4EALDH1A1HPGDRAB9A | |
| SCHEMBL8640237 | 0.77 | ALDH1A1 (0.43) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL2972065 | 0.76 | PDE10A (0.40) | GAAPDGFRBPDGFRACYP2A6CYP2E1 | |
| SCHEMBL8126098 | 0.75 | EGLN2 (0.50) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8117094 | 0.75 | ALDH1A1 (0.46) | GAAKDM4EALDH1A1HPGDPOLB | |
| SCHEMBL8124545 | 0.74 | KDM4E (0.51) | GAAKDM4EALDH1A1HPGDRAB9A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-7002861-A | — | — | None | — | — | JP | disclosed |
| US-5756509-A | FUNGICIDES | SHELL RESEARCH LIMITED (GB) | 1998-05-26 | — | — | US | disclosed |
| EP-0613900-B1 | Triazolopyrimidine derivatives with fungicidal activity | SHELL INT RESEARCH (NL) | 1997-05-14 | — | — | EP | disclosed |
| JP-H072861-A | TRIAZOLOPYRIMIDINE DERIVATIVE | SHELL INTERNATL RES MAATSCHAPPIJ BV | 1995-01-06 | — | — | JP | disclosed |
| EP-0613900-A1 | Triazolopyrimidine derivatives with fungicidal activity | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1994-09-07 | — | — | EP | disclosed |