Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL8531037 | 0.71 | ALDH1A1 (0.47) | ALDH1A1KDM4EPOLBGAATHRB | |
| SCHEMBL20393944 | 0.70 | ALDH1A1 (1.00) | ALDH1A1KDM4EL3MBTL1MEN1KMT2A | |
| SCHEMBL19197756 | 0.69 | PTGS2 (0.59) | PTGS2CHRM4ADRA2C | |
| SCHEMBL7338634 | 0.69 | AOC3 (0.62) | PTGS2CHRM4ADRA2CCA1CA2 | |
| SCHEMBL11790921 | 0.68 | CA1 (0.61) | ALDH1A1KDM4EPOLBL3MBTL1MEN1 | |
| SCHEMBL18924911 | 0.67 | SIGMAR1 (0.59) | ALDH1A1KDM4EPOLBMEN1KMT2A | |
| SCHEMBL8317756 | 0.67 | ALDH1A1 (0.81) | ALDH1A1KDM4EPOLBMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7272257 | 0.67 | AOC3 (0.50) | ALDH1A1KDM4EPOLBGAAMEN1 | |
| SCHEMBL11711681 | 0.66 | MEN1 (0.65) | ALDH1A1POLBGAATHRBL3MBTL1 | |
| Hydrochloric Acid SCHEMBL11684282 | 0.66 | HRH3 (0.54) | ALDH1A1POLBL3MBTL1MEN1KMT2A |
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-4024274-A | Benzylamine derivatives and process for preparing them | HOECHST AKTIENGESELLSCHAFT (DT) | 1977-05-17 | — | — | US | disclosed |