Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 9/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 11/20 | 0.55 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.53 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.48 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL17351540 | 0.85 | KDM4E (0.71) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL15573454 | 0.80 | KDM4E (0.67) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL18060168 | 0.77 | KDM4E (0.59) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL17351373 | 0.76 | KDM4E (0.97) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL6256096 | 0.76 | HSD17B10 (0.97) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL15572332 | 0.76 | HSD17B10 (0.43) | HSD17B10KDM4EALDH1A1HPGDNPSR1 | |
| SCHEMBL6252358 | 0.75 | KDM4E (1.00) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL16295335 | 0.75 | KDM4E (0.71) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL18060233 | 0.75 | KDM4E (0.63) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; SMN2 | |
| SCHEMBL17351539 | 0.75 | KDM4E (0.63) | HSD17B10KDM4EALDH1A1ADORA2ASMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9562052-B2 | Bicyclicpyridine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2017-02-07 | — | — | US | disclosed |
| US-9562052-B2 | Bicyclicpyridine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2017-02-07 | — | — | US | disclosed |
| EP-2888245-B1 | NEW BICYCLICPYRIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2016-09-21 | — | — | EP | disclosed |
| EP-2888245-B1 | NEW BICYCLICPYRIDINE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2016-09-21 | — | — | EP | disclosed |