Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | CA1 | P00915 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.48 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL23159630 | 0.89 | CNR2 (0.48) | MAPTKDM4ECA1CA2CA12 | |
| SCHEMBL20121418 | 0.89 | MAPT (0.46) | MAPTKDM4ECA1CA2CA12 | |
| SCHEMBL18940647 | 0.88 | KDM4E (0.49) | MAPTKDM4ECA1CA2CA12 | |
| Hydrochloric Acid SCHEMBL31215291 | 0.86 | KDM4E (0.47) | MAPTKDM4ECA1CA2CA12 | |
| Hydrochloric Acid SCHEMBL18940563 | 0.86 | KDM4E (0.47) | MAPTKDM4ECA1CA2CA12 | |
| SCHEMBL21343994 | 0.85 | MAPT (0.43) | MAPTKDM4ECA1CA2CA12 | |
| SCHEMBL15551607 | 0.82 | VCAM1 (0.48) | MAPTKDM4EALDH1A1LMNAPOLB | |
| SCHEMBL29577441 | 0.82 | VCAM1 (0.48) | MAPTKDM4EALDH1A1LMNAPOLB | |
| SCHEMBL31238916 | 0.81 | CNR2 (0.62) | MAPTKDM4ECA1CA2CA12 | |
| SCHEMBL10676568 | 0.81 | MAPT (0.49) | MAPTKDM4ECA1CA2CA12 |
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-4792557-A | 2,4-diamino-5[4-amino (or dimethylamino)-3,5-dimethoxybenzyl]pyrimidine and antibacterial composition thereof | HOFFMAN-LA ROCHE INC. (US) | 1988-12-20 | — | — | US | disclosed |
| US-4659818-A | Intermediates for benzylpyrimidines | HOFFMANN-LA ROCHE INC. (US) | 1987-04-21 | — | — | US | disclosed |
| US-4515948-A | BACTERICIDES, SULFA DRUG POTENTIATORS | HOFFMANN-LA ROCHE INC. (US) | 1985-05-07 | — | — | US | disclosed |