Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.33 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SLC6A13 | Q9NSD5 | 1/20 | 0.33 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.32 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.30 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27638291 | 1.00 | ALDH1A1 (0.40) | ALDH1A1SLC6A1SLC6A11TSHRLMNA | |
| SCHEMBL31499246 | 0.88 | SLC6A1 (0.38) | SLC6A1SLC6A11TSHRLMNASMN1; SMN2 | |
| SCHEMBL1206188 | 0.80 | POLB (0.38) | ALDH1A1 | |
| SCHEMBL3307745 | 0.80 | POLB (0.38) | ALDH1A1 | |
| SCHEMBL20793715 | 0.79 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2KDM2BL3MBTL3L3MBTL1 | |
| SCHEMBL3562770 | 0.76 | ALDH1A1 (0.51) | ALDH1A1LMNA | |
| SCHEMBL10316245 | 0.76 | ALDH1A1 (0.51) | ALDH1A1LMNA | |
| SCHEMBL26078165 | 0.76 | ALDH1A1 (0.51) | ALDH1A1LMNA | |
| SCHEMBL12881674 | 0.75 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2KDM2BL3MBTL3L3MBTL1 | |
| SCHEMBL3559763 | 0.75 | ALDH1A1 (0.46) | ALDH1A1LMNAL3MBTL3L3MBTL1 |
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-101365693-A | Selected CGRP antagonists, method for the production thereof and use thereof as medicaments | BOEHRINGER INGELHEIM INT (DE) | 2009-02-11 | — | — | CN | disclosed |