Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL21872442 | 0.76 | CYP3A4 (0.38) | CYP3A4TSHRRECQLALDH1A1MAPT | |
| SCHEMBL9070341 | 0.74 | CYP3A4 (0.47) | CYP3A4TSHRRECQLALDH1A1MAPT | |
| SCHEMBL3631632 | 0.71 | KMT2A (0.40) | CYP3A4TSHRRECQLALDH1A1MEN1 | |
| SCHEMBL18805568 | 0.69 | GABRA1 (0.33) | TSHRALDH1A1MEN1MAPTKMT2A | |
| SCHEMBL15047754 | 0.69 | KDM1A (0.36) | CYP3A4TSHRALDH1A1MEN1MAPT | |
| SCHEMBL1478306 | 0.69 | KDM1A (0.45) | ALDH1A1HDAC1HDAC6 | |
| SCHEMBL30228644 | 0.69 | KDM1A (0.45) | ALDH1A1HDAC1HDAC6 | |
| SCHEMBL23519806 | 0.69 | CYP3A4 (0.36) | CYP3A4TSHRRECQL | |
| SCHEMBL1015921 | 0.68 | RECQL (0.60) | CYP3A4TSHRRECQLALDH1A1MEN1 | |
| SCHEMBL14044063 | 0.68 | TSHR (0.41) | CYP3A4TSHRRECQLALDH1A1MEN1 |
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-1720545-B1 | BICYCLIC AND BRIDGED NITROGEN HETEROCYCLES | CHEMOCENTRYX INC (US) | 2014-10-29 | — | — | EP | disclosed |