Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.40 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 3/20 | 0.35 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17372216 | 0.81 | PARP1 (0.43) | PARP1HSD17B14MAPTALDH1A1MAPK1 | |
| SCHEMBL24238678 | 0.76 | SMN1; SMN2 (0.44) | MAPTALDH1A1HSD11B1KDM4E | |
| SCHEMBL29993116 | 0.76 | SMN1; SMN2 (0.44) | MAPTALDH1A1HSD11B1KDM4E | |
| SCHEMBL21566182 | 0.73 | PTPN1 (0.41) | PTPN1GSK3B | |
| SCHEMBL22045138 | 0.72 | KCNQ3 (0.41) | MAPTALDH1A1POLBNPC1RAB9A | |
| SCHEMBL22044690 | 0.71 | MAOB (0.41) | PARP1MAPTALDH1A1MAPK1POLB | |
| Bromide SCHEMBL16753263 | 0.70 | GABRP (0.40) | PTPN1GSK3B | |
| SCHEMBL25190538 | 0.70 | PTPN1 (0.39) | PTPN1GSK3B | |
| SCHEMBL31438552 | 0.70 | PTPN1 (0.39) | PTPN1GSK3B | |
| SCHEMBL31195870 | 0.69 | ALDH1A1 (0.42) | PARP1MAPTALDH1A1MAPK1POLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020109224-A1 | FURTHER HETEROAROMATIC COMPOUNDS HAVING ACTIVITY AGAINST RSV | Janssen Sciences Ireland Unlimited Company (IE) | 2020-06-04 | — | — | WO | disclosed |