Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPRC | P08575 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA7 | P43166 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | ATM | Q13315 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.40 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8058115 | 0.82 | MAPT (0.39) | CA12CA2CA9CA1CA7 | |
| SCHEMBL8058208 | 0.79 | ALDH1A1 (0.49) | KMT2ACA12CA2CA9CA1 | |
| SCHEMBL5904274 | 0.79 | PTPRC (0.47) | PTPRCKMT2ACA12CA2CA9 | |
| SCHEMBL8045078 | 0.77 | MAPT (0.35) | KMT2AALDH1A1ATMLMNAKDM4E | |
| SCHEMBL1102209 | 0.77 | ALDH1A1 (0.45) | PTPRCKMT2ACA12CA2CA9 | |
| SCHEMBL8258364 | 0.76 | CA1 (0.45) | PTPRCKMT2ACA12CA2CA9 | |
| SCHEMBL31098601 | 0.76 | SMYD3 (0.53) | PTPRCKMT2ACTDSP1CA12CA2 | |
| SCHEMBL4611577 | 0.76 | SMYD3 (0.53) | PTPRCKMT2ACTDSP1CA12CA2 | |
| SCHEMBL22011240 | 0.75 | KMT2A (0.47) | PTPRCKMT2ACTDSP1CA12CA2 | |
| SCHEMBL22011243 | 0.75 | KMT2A (0.47) | PTPRCKMT2ACTDSP1CA12CA2 |
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-6028069-A | Heterocyclyl-condensed benzoylguanidines, their production and use as inhibitors of the cellular Na+/H+-antiporter | MERCK PATENT GESELLSCHAFT MIT BERSCHRANKER HAFTUNG (DE) | 2000-02-22 | — | — | US | disclosed |