Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.54 |
| ▸ | PIM1 | P11309 | 7/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.45 |
| ▸ | NAT1 | P18440 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.45 |
| ▸ | THRB | P10828 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.45 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8180533 | 0.87 | GSK3B (0.71) | GSK3BPIM1KMT2AMEN1NAT1 | |
| SCHEMBL9254893 | 0.84 | GSK3B (0.75) | GSK3BPIM1KMT2ARAB9AMEN1 | |
| SCHEMBL9254899 | 0.84 | GSK3B (0.75) | GSK3BPIM1KMT2ARAB9AMEN1 | |
| SCHEMBL8182711 | 0.82 | GSK3B (0.68) | GSK3BPIM1KMT2AMEN1NAT1 | |
| SCHEMBL8182708 | 0.82 | GSK3B (0.68) | GSK3BPIM1KMT2AMEN1NAT1 | |
| SCHEMBL8181146 | 0.77 | PIM1 (0.71) | PIM1KMT2ARAB9AMEN1PTP4A3 | |
| SCHEMBL8171930 | 0.76 | PDE4B (0.51) | PIM1KMT2ARAB9AMEN1PTP4A3 | |
| SCHEMBL8177340 | 0.73 | GSK3B (0.58) | GSK3BPIM1KMT2ARAB9AMEN1 | |
| SCHEMBL8177338 | 0.73 | GSK3B (0.58) | GSK3BPIM1KMT2ARAB9AMEN1 | |
| SCHEMBL8182589 | 0.72 | GSK3B (0.43) | GSK3BCYP2A6 |
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-2000018748-A1 | RHODANINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF METABOLIC BONE DISORDERS | ROCHE DIAGNOSTICS GMBH (DE) | 2000-04-06 | — | — | WO | disclosed |