Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | XDH | P47989 | 2/20 | 0.40 |
| ▸ | GFER | P55789 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11362728 | 0.87 | KDM4E (0.48) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL11357499 | 0.81 | ALDH1A1 (0.41) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL11367480 | 0.78 | KDM4E (0.41) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL24662642 | 0.78 | CA1 (0.47) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL11371204 | 0.74 | CA1 (0.50) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL11358739 | 0.74 | CA1 (0.50) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL11351598 | 0.73 | CA1 (0.48) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL24662617 | 0.70 | CA12 (0.46) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL11358211 | 0.69 | CA1 (0.44) | KDM4EALDH1A1CA1CA2CA12 | |
| SCHEMBL20121418 | 0.69 | MAPT (0.46) | KDM4EALDH1A1CA1CA2CA12 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4251454-A | MADE FROM ANILINOMETHYLENE CHLORO-AMINO-HYDROCINNAMONITRILE | HOFFMANN-LA ROCHE INC. (US) | 1981-02-17 | — | — | US | disclosed |
| US-4039543-A | SUBSTITUTED BY AMINE, N-RING, AMIDE, CARBAMATE, UREA | HOFFMANN-LA ROCHE INC. (US) | 1977-08-02 | — | — | US | disclosed |