Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | LMNA | P02545 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15769992 | 0.85 | MAPT (0.51) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 | |
| SCHEMBL20683228 | 0.81 | MAPK1 (0.48) | MAPTALDH1A1LMNAKMT2AHPGD | |
| SCHEMBL28030695 | 0.81 | MAPT (0.42) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 | |
| SCHEMBL208825 | 0.75 | MAPT (0.45) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 | |
| SCHEMBL14216593 | 0.74 | MAPT (0.51) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 | |
| SCHEMBL16152486 | 0.72 | MAPT (0.38) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 | |
| SCHEMBL22652221 | 0.71 | L3MBTL1 (0.51) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 | |
| SCHEMBL17965887 | 0.71 | POLB (0.38) | MAPTALDH1A1LMNAL3MBTL1CYP2C9 | |
| SCHEMBL9567452 | 0.69 | MAPT (0.57) | MAPTALDH1A1LMNAL3MBTL1KMT2A | |
| SCHEMBL15770379 | 0.69 | MAPT (0.46) | MAPTALDH1A1LMNAL3MBTL1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104903325-A | COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE | VERTEX PHARMA | 2015-09-09 | — | — | CN | disclosed |