Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.43 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.43 |
| ▸ | JMJD6 | Q6NYC1 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10397302 | 0.86 | PKM (0.51) | PTPN1CA12CA1CA2CA7 | |
| SCHEMBL10606130 | 0.83 | CA1 (0.68) | CA12CA1CA2CA7CA9 | |
| SCHEMBL39597 | 0.83 | PTPN1 (0.71) | PTPN1CA12CA1CA2CA7 | |
| Water SCHEMBL10398682 | 0.82 | CA1 (0.66) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10605834 | 0.81 | KDM4E (0.62) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10398192 | 0.80 | CA12 (0.68) | PTPN1CA12CA1CA2CA7 | |
| Water SCHEMBL10398700 | 0.79 | KDM4E (0.61) | CA12CA1CA2CA7CA9 | |
| SCHEMBL10398466 | 0.79 | ALDH1A1 (0.65) | PTPN1CA12CA1CA2CA7 | |
| SCHEMBL10398684 | 0.78 | ESR1 (0.66) | TSHRKDM4EPOLBHDAC6ESR1 | |
| SCHEMBL10398443 | 0.78 | CA12 (0.49) | PTPN1CA12CA1CA2CA7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4965395-A | BACTERICIDES | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1990-10-23 | — | — | US | disclosed |
| EP-0224592-B1 | P-HYDROXYBENZOIC ACID DERIVATIVES | Yoshitomi Pharmaceutical Industries, Ltd. (JP) | 1989-11-15 | — | — | EP | disclosed |
| EP-0224592-A1 | p-HYDROXYBENZOIC ACID DERIVATIVES | Yoshitomi Pharmaceutical Industries, Ltd. (JP) | 1987-06-10 | — | — | EP | disclosed |