Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.33 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21889711 | 0.85 | KMT2A (0.34) | ACKR3 | |
| SCHEMBL20927064 | 0.78 | KMT2A (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4ACKR3 | |
| SCHEMBL9005243 | 0.76 | EGFR (0.41) | CHRNB2CHRNB4CHRNA3CHRNA4ACKR3 | |
| SCHEMBL22332213 | 0.75 | ALDH1A1 (0.38) | CHRNB2CHRNB4CHRNA3CHRNA4ACKR3 | |
| SCHEMBL24690684 | 0.75 | ALDH1A1 (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4ACKR3 | |
| SCHEMBL19069390 | 0.74 | ACKR3 (0.36) | ACKR3 | |
| SCHEMBL20939084 | 0.74 | ACKR3 (0.36) | ACKR3 | |
| SCHEMBL20938920 | 0.73 | ACKR3 (0.34) | CHRNB2CHRNB4CHRNA3CHRNA4ACKR3 | |
| SCHEMBL21889708 | 0.72 | MEN1 (0.44) | — | |
| SCHEMBL22355637 | 0.70 | ACKR3 (0.30) | ACKR3 |
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-2020055973-A1 | ESTROGEN RECEPTOR TARGETING ANTAGONISTS | XAVIER UNIVERSITY OF LOUISIANA (US) | 2020-03-19 | — | — | WO | disclosed |