Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.52 |
| ▸ | CA2 | P00918 | 5/20 | 0.52 |
| ▸ | CA7 | P43166 | 4/20 | 0.52 |
| ▸ | CA9 | Q16790 | 4/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.47 |
| ▸ | TOP1 | P11387 | 1/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19441159 | 0.89 | CA1 (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL146841 | 0.86 | CA1 (0.61) | CA1CA2CA7CA9CA12 | |
| SCHEMBL18550731 | 0.85 | ALDH1A1 (0.57) | CA1CA2CA7CA9CA12 | |
| SCHEMBL14118291 | 0.85 | CA1 (0.55) | CA1CA2CA7CA9CA12 | |
| SCHEMBL4477977 | 0.84 | CD274 (0.50) | CA1CA2CA7CA9CA12 | |
| SCHEMBL6313020 | 0.84 | ALDH1A1 (0.51) | CA1CA2CA7CA9CA12 | |
| SCHEMBL19911767 | 0.82 | ERN1 (0.56) | CA1CA2TOP1ALDH1A1MAPT | |
| SCHEMBL26073494 | 0.81 | CA1 (0.40) | CA1CA2CA7CA9CA12 | |
| SCHEMBL26140509 | 0.80 | APP (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL6011746 | 0.80 | ALDH1A1 (0.41) | CD274ALDH1A1MAPTLMNAKDM4E |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019008156-A1 | INHIBITORS OF THE PD-1/PD-L1 PROTEIN/PROTEIN INTERACTION | RIJKSUNIVERSITEIT GRONINGEN (NL) | 2019-01-10 | — | — | WO | disclosed |
| EP-0831083-B1 | Process for synthesizing benzoic acids | ROHM & HAAS (US) | 2001-03-14 | — | — | EP | disclosed |
| US-5965766-A | Process for synthesizing benzoic acids | ROHM AND HAAS COMPANY (US) | 1999-10-12 | — | — | US | disclosed |
| US-5917079-A | Process for synthesizing benzoic acids | ROHM AND HAAS COMPANY (US) | 1999-06-29 | — | — | US | disclosed |
| EP-0831083-A1 | Process for synthesizing benzoic acids | ROHM AND HAAS COMPANY (US) | 1998-03-25 | — | — | EP | disclosed |