Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | CA9 | Q16790 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 2/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.37 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.37 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CDC25A | P30304 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4593472 | 0.80 | SRC (0.36) | EGFRCA12CA1CA2CA9 | |
| SCHEMBL5692310 | 0.77 | ALDH1A1 (0.44) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL10955013 | 0.77 | ALDH1A1 (0.52) | CA12CA1CA2ALDH1A1GAA | |
| SCHEMBL1930853 | 0.76 | EGFR (0.53) | EGFRCA12CA1CA2CA9 | |
| SCHEMBL28670574 | 0.76 | LMNA (0.50) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL21518479 | 0.76 | ALDH1A1 (0.58) | CA12CA1CA2ALDH1A1AGTR1 | |
| SCHEMBL8074105 | 0.75 | HSD17B14 (0.43) | EGFRCA12CA1CA2CA9 | |
| SCHEMBL808952 | 0.75 | CYP2A6 (0.48) | ALDH1A1AGTR1SMN1; SMN2GAAMAPT | |
| SCHEMBL5289171 | 0.75 | HPGD (0.54) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL4805587 | 0.74 | MAPT (0.60) | ALDH1A1GAAMAPTKDM4ELMNA |
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-5783689-A | Antibacterial and antifungal nucleosides | UNIVERSITY OF NOTRE DAME (US) | 1998-07-21 | — | — | US | disclosed |