Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA9 | Q16790 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.49 |
| ▸ | MEN1 | O00255 | 5/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | GLA | P06280 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28473346 | 0.77 | ALDH1A1 (0.46) | CA1CA2KMT2AMEN1ALDH1A1 | |
| SCHEMBL10752705 | 0.75 | HCAR3 (0.74) | HCAR3KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL11687868 | 0.75 | GAA (0.59) | KMT2AMEN1ALDH1A1MAPTNPC1 | |
| SCHEMBL1134873 | 0.71 | RAB9A (0.58) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL5736108 | 0.70 | MAPT (0.49) | HCAR3CA12CA1CA2CA9 | |
| SCHEMBL641989 | 0.70 | PHGDH (0.77) | HCAR3CA12CA1CA9KMT2A | |
| SCHEMBL19174351 | 0.70 | HDAC2 (0.76) | KMT2AMEN1ALDH1A1MAPTNPC1 | |
| SCHEMBL28430328 | 0.69 | PDPK1 (0.54) | HCAR3KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL27720607 | 0.69 | KMT2A (0.58) | HCAR3KMT2AMEN1ALDH1A1MAPT | |
| SCHEMBL6974844 | 0.69 | KMT2A (0.62) | KMT2AMEN1ALDH1A1MAPTNPC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0616609-B1 | NITROANILINE DERIVATIVES AND THEIR USE AS ANTITUMOR AGENTS | CANCER RES CAMPAIGN TECH (GB) | 1997-06-18 | — | — | EP | disclosed |