Predicted protein targets (top 2)
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 | |
|---|---|---|---|---|
| SCHEMBL10188228 | 0.88 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL1003621 | 0.75 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL18469470 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL2558116 | 0.72 | TSHR (0.31) | TSHRTDP1 | |
| SCHEMBL23666611 | 0.71 | — | — | |
| SCHEMBL3412332 | 0.71 | TSHR (0.33) | TSHRTDP1 | |
| SCHEMBL7931700 | 0.69 | TSHR (0.32) | TSHRTDP1 | |
| SCHEMBL13769072 | 0.69 | TSHR (0.32) | TSHRTDP1 | |
| SCHEMBL19335032 | 0.67 | — | — | |
| Ethylamine SCHEMBL8740213 | 0.67 | CYP2D6 (0.32) | — |
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-2017044633-A1 | PEPTIDOMIMETIC MACROCYCLES AS MODULATORS OF MCL-1 | AILERON THERAPEUTICS, INC. (US) | 2017-03-16 | — | — | WO | disclosed |