Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CDK1 | P06493 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8583066 | 0.90 | PPARG (0.36) | ALDH1A1HPGDKDM4EMAPTPKM | |
| SCHEMBL8573125 | 0.88 | KDM4E (0.38) | ALDH1A1HPGDKDM4EMAPTPKM | |
| SCHEMBL8582507 | 0.88 | CNR2 (0.38) | ALDH1A1HPGDKDM4EMAPTPKM | |
| SCHEMBL8579892 | 0.86 | CNR2 (0.42) | ALDH1A1KMT2A | |
| SCHEMBL8578814 | 0.86 | KDM4E (0.40) | ALDH1A1HPGDKDM4EMAPTHSD17B10 | |
| SCHEMBL8580983 | 0.85 | CNR2 (0.42) | ALDH1A1HPGDKDM4EKMT2A | |
| SCHEMBL8584243 | 0.83 | PDGFRB (0.45) | ALDH1A1HPGDKDM4EMAPTHSD17B10 | |
| SCHEMBL8581653 | 0.82 | HTT (0.45) | KDM4EHSD17B10KMT2ASMN1; SMN2POLB | |
| SCHEMBL8581950 | 0.81 | ALDH1A1 (0.40) | ALDH1A1HPGDKDM4EMAPTPKM | |
| SCHEMBL8582889 | 0.81 | KDM4E (0.35) | ALDH1A1HPGDKDM4EMAPTHSD17B10 |
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-5840761-A | Alkylbenzoylguanidine derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1998-11-24 | — | — | US | disclosed |