Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.32 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | TNKS | O95271 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21413819 | 0.74 | ESR1 (0.33) | PTGS1PTGS2TNKSPARP1TNKS2 | |
| SCHEMBL24183547 | 0.69 | NR3C1 (0.35) | — | |
| SCHEMBL22965417 | 0.67 | GSTP1 (0.40) | — | |
| SCHEMBL27117088 | 0.66 | CYP1A2 (0.43) | PTGS1PTGS2TNKSPARP1TNKS2 | |
| SCHEMBL19807312 | 0.65 | SLC9A1 (0.41) | — | |
| SCHEMBL18655331 | 0.64 | GSTP1 (0.40) | — | |
| SCHEMBL24605014 | 0.62 | HPRT1 (0.33) | — | |
| SCHEMBL20356017 | 0.62 | CA3 (0.48) | — | |
| SCHEMBL8248035 | 0.61 | ALDH1A1 (0.38) | PTGS1PTGS2 | |
| SCHEMBL1527268 | 0.61 | GSTP1 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9783525-B2 | Map kinase modulators and uses thereof | THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) | 2017-10-10 | — | — | US | disclosed |