Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.41 |
| ▸ | FDPS | P14324 | 3/20 | 0.41 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28132173 | 1.00 | TSHR (0.47) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL20746325 | 0.97 | DNM1 (0.50) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL20746369 | 0.97 | DNM1 (0.50) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL28846487 | 0.97 | TSHR (0.50) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL28264637 | 0.97 | TSHR (0.50) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL28399942 | 0.97 | TSHR (0.50) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL28217277 | 0.95 | LMNA (0.42) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL23040337 | 0.94 | TSHR (0.47) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL11745325 | 0.94 | TSHR (0.47) | TSHRTHRBLMNADNM1OPRM1 | |
| SCHEMBL10953445 | 0.94 | TSHR (0.47) | TSHRTHRBLMNADNM1OPRM1 |
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-105593230-A | Cathepsin cysteine protease inhibitors | MERCK SHARP & DOHME | 2016-05-18 | — | — | CN | disclosed |