Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 5/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | IL1RN | P18510 | 1/20 | 0.38 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 2/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 2/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.34 |
| ▸ | ACP1 | P24666 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28498204 | 0.80 | CA1 (0.47) | CA2CA1PTGS1PTGS2CA9 | |
| SCHEMBL28958586 | 0.78 | CA2 (0.38) | CA2CA1CA9PTPN1CA12 | |
| SCHEMBL28958553 | 0.78 | TDP1 (0.38) | CA2PTPN1ALDH1A1MEN1PKM | |
| SCHEMBL9543035 | 0.78 | CA2 (0.44) | CA2KEAP1CA1IL1RNERAP1 | |
| SCHEMBL28502057 | 0.77 | CA2 (0.47) | CA2CA1CA9CA5AALDH1A1 | |
| SCHEMBL3226500 | 0.76 | CA2 (0.43) | CA2KEAP1CA1IL1RNERAP1 | |
| SCHEMBL27848346 | 0.74 | CA1 (0.52) | CA2KEAP1CA1IL1RNERAP1 | |
| SCHEMBL10579140 | 0.74 | CA2 (0.41) | CA2KEAP1CA1IL1RNERAP1 | |
| SCHEMBL9492832 | 0.74 | KEAP1 (0.52) | CA2KEAP1CA1IL1RNERAP1 | |
| SCHEMBL9009533 | 0.74 | ACP1 (0.44) | CA2KEAP1CA1IL1RNERAP1 |
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-5597931-A | Total synthesis of taxol and analogues thereof | SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) | 1997-01-28 | — | — | US | disclosed |
| EP-0286914-B1 | PROCESS FOR THE PREPARATION OF TRIFLUOROMETHANESULFONIC ACID | BAYER AG (DE) | 1991-03-20 | — | — | EP | disclosed |
| EP-0286914-A1 | Process for the preparation of trifluoromethanesulfonic acid | BAYER AG (DE) | 1988-10-19 | — | — | EP | disclosed |