Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAT1 | P18440 | 5/20 | 0.75 |
| ▸ | CA2 | P00918 | 1/20 | 0.75 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.75 |
| ▸ | CRHBP | P24387 | 3/20 | 0.70 |
| ▸ | CRHR2 | Q13324 | 3/20 | 0.70 |
| ▸ | MMP3 | P08254 | 2/20 | 0.67 |
| ▸ | MMP13 | P45452 | 2/20 | 0.67 |
| ▸ | MYC | P01106 | 3/20 | 0.62 |
| ▸ | MAX | P61244 | 2/20 | 0.62 |
| ▸ | CISD1 | Q9NZ45 | 2/20 | 0.62 |
| ▸ | RAB9A | P51151 | 2/20 | 0.62 |
| ▸ | NPC1 | O15118 | 1/20 | 0.62 |
| ▸ | IL1RN | P18510 | 1/20 | 0.62 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.62 |
| ▸ | GSK3B | P49841 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | PIM1 | P11309 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL8173568 | 1.00 | NAT1 (0.75) | NAT1CA2EPHX1CRHBPCRHR2 | |
| SCHEMBL4416451 | 0.86 | NAT1 (1.00) | NAT1CA2EPHX1MMP3MMP13 | |
| SCHEMBL3491175 | 0.86 | NAT1 (1.00) | NAT1CA2EPHX1MMP3MMP13 | |
| SCHEMBL1812224 | 0.86 | NAT1 (1.00) | NAT1CA2EPHX1MMP3MMP13 | |
| SCHEMBL10596480 | 0.84 | NAT1 (1.00) | NAT1CA2EPHX1CRHBPCRHR2 | |
| SCHEMBL1247510 | 0.84 | NAT1 (1.00) | NAT1CA2EPHX1CRHBPCRHR2 | |
| SCHEMBL1247509 | 0.84 | NAT1 (1.00) | NAT1CA2EPHX1CRHBPCRHR2 | |
| SCHEMBL8180288 | 0.83 | XDH (0.67) | NAT1CA2EPHX1CRHBPCRHR2 | |
| SCHEMBL8180287 | 0.83 | XDH (0.67) | NAT1CA2EPHX1CRHBPCRHR2 | |
| SCHEMBL194558 | 0.82 | CRHBP (1.00) | NAT1CA2EPHX1CRHBPCRHR2 |
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 |