Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.65 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | F13A1 | P00488 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
| ▸ | CA6 | P23280 | 2/20 | 0.50 |
| ▸ | CA5A | P35218 | 2/20 | 0.50 |
| ▸ | THPO | P40225 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.50 |
| ▸ | CASP2 | P42575 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL1072934 | 0.90 | MAPT (0.73) | MAPTALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL8628601 | 0.88 | ALDH1A1 (0.77) | MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL12477885 | 0.88 | ALDH1A1 (0.70) | MAPTALDH1A1CYP1A2CYP2C19HDAC3 | |
| SCHEMBL1493178 | 0.88 | ALDH1A1 (0.70) | MAPTALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL5139921 | 0.88 | ALDH1A1 (0.85) | MAPTALDH1A1 | |
| SCHEMBL21800026 | 0.86 | ALDH1A1 (0.67) | MAPTALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL21799912 | 0.86 | ALDH1A1 (0.67) | MAPTALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL1937279 | 0.86 | ALDH1A1 (0.60) | MAPTALDH1A1CA12CA2ALOX15 | |
| SCHEMBL21224348 | 0.86 | ALDH1A1 (0.67) | MAPTALDH1A1HDAC3HDAC1HDAC2 | |
| SCHEMBL21799841 | 0.86 | ALDH1A1 (0.67) | MAPTALDH1A1HDAC3HDAC1HDAC2 |
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-2017105565-A2 | COMPOSITIONS FOR THERAPEUTICS, TARGETED PET IMAGING AND METHODS OF THEIR USE | MEMORIAL SLOAN KETTERING CANCER CENTER (US) | 2017-06-22 | — | — | WO | disclosed |