Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR17 | Q13304 | 2/20 | 0.45 |
| ▸ | P2RY2 | P41231 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | PKM | P14618 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HTR6 | P50406 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11840565 | 0.88 | PGR (0.42) | GPR17P2RY2ALDH1A1MEN1MAPT | |
| SCHEMBL11448513 | 0.84 | GPR17 (0.50) | GPR17P2RY2ALDH1A1PKMMEN1 | |
| SCHEMBL11448993 | 0.83 | CA2 (0.50) | ALDH1A1PKMKDM4EMEN1MAPT | |
| SCHEMBL10925848 | 0.82 | TDP1 (0.47) | GPR17ALDH1A1PKMKDM4EMEN1 | |
| SCHEMBL11448629 | 0.82 | SMN1; SMN2 (0.50) | GPR17ALDH1A1PKMKDM4EMEN1 | |
| SCHEMBL11448257 | 0.82 | CYP3A4 (0.48) | GPR17P2RY2ALDH1A1PKMKDM4E | |
| SCHEMBL11448385 | 0.82 | F2 (0.50) | GPR17P2RY2ALDH1A1MEN1MAPT | |
| SCHEMBL11091725 | 0.80 | CA2 (0.46) | ALDH1A1PKMKDM4EMEN1MAPT | |
| SCHEMBL11583355 | 0.78 | GPR17 (0.45) | GPR17P2RY2ALDH1A1KDM4EMEN1 | |
| SCHEMBL11449418 | 0.78 | GPR17 (0.48) | GPR17ALDH1A1PKMKDM4EMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4216161-A | 3,4-Diaminophenyl sulfonic acid esters | HOECHST AKTIENGESELLSCHAFT (DE) | 1980-08-05 | — | — | US | disclosed |
| US-3996369-A | Anthelmintically active 2-carbalkoxyamino benzimidazolyl-5(6)-sulfonic acid phenyl esters | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-12-07 | — | — | US | disclosed |