Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | VNN1 | O95497 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL4375383 | 0.85 | MAPT (0.50) | MAPTMMP13POLBVNN1SMN1; SMN2 | |
| SCHEMBL1561258 | 0.82 | MAPT (0.47) | MAPTMMP13POLBVNN1SMN1; SMN2 | |
| SCHEMBL19012442 | 0.77 | MAPT (0.45) | MAPTPOLBVNN1HTTALDH1A1 | |
| SCHEMBL13744773 | 0.76 | SIGMAR1 (0.47) | MAPTVNN1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL24511505 | 0.75 | DPP4 (0.40) | KMT2AMEN1ALDH1A1 | |
| SCHEMBL30967385 | 0.75 | CHRNB2 (0.41) | MAPTMMP13POLBVNN1CA12 | |
| SCHEMBL1562092 | 0.75 | MAPT (0.44) | MAPTMMP13POLBVNN1SMN1; SMN2 | |
| SCHEMBL31097151 | 0.74 | HPGD (0.43) | SMN1; SMN2KMT2AMEN1HTTALDH1A1 | |
| SCHEMBL8004202 | 0.74 | MAPT (0.43) | MAPTMMP13POLBVNN1SMN1; SMN2 | |
| SCHEMBL6876833 | 0.74 | MAPT (0.43) | MAPTMMP13POLBVNN1SMN1; SMN2 |
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-2011098607-A1 | SALTS AND HYDRATES OF 4-[(3-CHLOR-4-FLUORO-PHENYL)AMINO]-6-(CIS-4-{N-[(MORPH-1-OLINO-4-YL)CARBONYL]-N-METHYL-AMINO}-CYCLOHEXANE-1-YLOXY)-7-METHOXY-QUINAZOLINE, THEIR USE AS DRUGS AND THEIR PRODUCTION | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-08-18 | — | — | WO | disclosed |