Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA7 | P43166 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | SCN4A | P35499 | 8/20 | 0.35 |
| ▸ | MAOA | P21397 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SCN1A | P35498 | 2/20 | 0.35 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24130172 | 0.85 | ACHE (0.48) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL24117088 | 0.85 | ACHE (0.48) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL13033998 | 0.80 | CA1 (0.48) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL598366 | 0.77 | CA1 (0.50) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL11877948 | 0.77 | CA1 (0.50) | CA1CA2CA7CA9CYP1A2 | |
| Ammonia Solution, Strong SCHEMBL7990175 | 0.74 | CA1 (0.48) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL3163029 | 0.74 | CA1 (0.42) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL10386817 | 0.72 | CA1 (0.46) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL11860183 | 0.72 | CA1 (0.46) | CA1CA2CA7CA9CYP1A2 | |
| SCHEMBL578005 | 0.72 | CA1 (0.46) | CA1CA2CA7CA9CYP1A2 |
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-2020190754-A1 | MACROCYCLIC AZOLOPYRIDINE DERIVATIVES AS EED AND PRC2 MODULATORS | Fulcrum Therapeutics, Inc. (US) | 2020-09-24 | — | — | WO | disclosed |