Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | ILK | Q13418 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2968143 | 0.87 | SLC9A1 (0.42) | SLC9A1HSD17B10VCAM1CA1CA2 | |
| SCHEMBL8580625 | 0.85 | SLC9A1 (0.45) | ALDH1A1SLC9A1HSD17B10VCAM1CA1 | |
| SCHEMBL31401278 | 0.81 | ALDH1A1 (0.42) | ALDH1A1SLC9A1HSD17B10HPGD | |
| SCHEMBL8585036 | 0.81 | SLC9A1 (0.45) | ALDH1A1SLC9A1PKMHSD17B10HPGD | |
| SCHEMBL8583149 | 0.81 | ALDH1A1 (0.38) | ALDH1A1PKMHSD17B10HPGDTSHR | |
| SCHEMBL19993672 | 0.81 | MAPT (0.42) | ALDH1A1HSD17B10HPGDTSHRCA1 | |
| SCHEMBL8573449 | 0.81 | CA2 (0.41) | ALDH1A1SLC9A1HSD17B10VCAM1CA1 | |
| SCHEMBL8580952 | 0.81 | GAA (0.46) | ALDH1A1HSD17B10KDM4ESMN1; SMN2 | |
| SCHEMBL8582974 | 0.80 | CDK1 (0.38) | ALDH1A1SLC9A1HSD17B10VCAM1CA1 | |
| SCHEMBL6749760 | 0.80 | SLC9A1 (0.54) | ALDH1A1SLC9A1HSD17B10VCAM1CA1 |
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 |