Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.37 |
| ▸ | SMO | Q99835 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.34 |
| ▸ | CGAS | Q8N884 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 2/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | GRIN1 | Q05586 | 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 | |
|---|---|---|---|---|
| SCHEMBL11976394 | 0.80 | SMO (0.48) | SMOACSS2ALDH1A1RAB9A | |
| SCHEMBL12826058 | 0.80 | SMO (0.45) | SMOACSS2KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16230017 | 0.74 | LMNA (0.41) | EGFRSMOLMNAKDM4EALDH1A1 | |
| SCHEMBL17677350 | 0.73 | KMT2A (0.43) | SMOLMNAKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16230015 | 0.71 | L3MBTL1 (0.40) | EGFRLMNAKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10316192 | 0.71 | SMO (0.47) | SMOALDH1A1 | |
| SCHEMBL16230004 | 0.67 | SMO (0.47) | SMOALDH1A1 | |
| SCHEMBL10004581 | 0.66 | SMO (0.49) | SMOLMNAALDH1A1RAB9A | |
| SCHEMBL17677378 | 0.66 | MEN1 (0.41) | SMOLMNAKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL10316151 | 0.66 | SMO (0.52) | SMORAB9ACNR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2471791-B1 | FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2014-11-12 | — | — | EP | disclosed |