Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAT1 | P18440 | 4/20 | 0.63 |
| ▸ | CA2 | P00918 | 1/20 | 0.63 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.63 |
| ▸ | CDC25B | P30305 | 1/20 | 0.52 |
| ▸ | MMP3 | P08254 | 2/20 | 0.50 |
| ▸ | MMP13 | P45452 | 2/20 | 0.50 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.50 |
| ▸ | METAP1 | P53582 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8171935 | 1.00 | NAT1 (0.63) | NAT1CA2EPHX1CDC25BMMP3 | |
| SCHEMBL22409611 | 0.78 | PIM1 (0.67) | NAT1CA2EPHX1CDC25BMAPK10 | |
| SCHEMBL22423780 | 0.78 | PIM1 (0.67) | NAT1CA2EPHX1CDC25BMAPK10 | |
| SCHEMBL13846678 | 0.78 | PIM1 (0.67) | NAT1CA2EPHX1CDC25BMAPK10 | |
| SCHEMBL8181632 | 0.78 | PIM1 (0.54) | NAT1CDC25BMAPK10GSK3BMEN1 | |
| SCHEMBL8181630 | 0.78 | PIM1 (0.54) | NAT1CDC25BMAPK10GSK3BMEN1 | |
| SCHEMBL8172035 | 0.78 | AKR1B1 (0.52) | NAT1CA2EPHX1MMP3MMP13 | |
| SCHEMBL8181146 | 0.78 | PIM1 (0.71) | NAT1CA2EPHX1MMP3MMP13 | |
| SCHEMBL8190582 | 0.78 | POLB (0.57) | CDC25BRAB9AALDH1A1MEN1KMT2A | |
| SCHEMBL8190580 | 0.78 | POLB (0.57) | CDC25BRAB9AALDH1A1MEN1KMT2A |
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 |