Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALPL | P05186 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20529642 | 1.00 | ALDH1A1 (0.62) | ALDH1A1CYP3A4KDM4ATSHRGAA | |
| SCHEMBL940348 | 0.90 | ALDH1A1 (0.43) | ALDH1A1CYP3A4TSHRHTTSMN1; SMN2 | |
| SCHEMBL11598205 | 0.83 | ALDH1A1 (0.65) | ALDH1A1CYP3A4KDM4AGAAMAPT | |
| SCHEMBL80644 | 0.79 | — | — | |
| SCHEMBL24586981 | 0.78 | — | — | |
| SCHEMBL11598222 | 0.76 | ALDH1A1 (0.54) | ALDH1A1CYP3A4KDM4AGAAMAPT | |
| SCHEMBL11549138 | 0.73 | — | — | |
| SCHEMBL6208095 | 0.73 | MEN1 (0.50) | ALDH1A1CYP3A4GAAMAPTHTT | |
| SCHEMBL6209344 | 0.73 | MEN1 (0.50) | ALDH1A1CYP3A4GAAMAPTHTT | |
| SCHEMBL3698245 | 0.73 | ALDH1A1 (0.50) | ALDH1A1CYP3A4KDM4AGAAMAPT |
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-2018187414-A1 | INHIBITORS OF MTOR-RICTOR INTERACTIONS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2018-10-11 | — | — | WO | disclosed |