Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Pyridazine SCHEMBL5104 | 0.89 | — | — | |
| Pyridazine SCHEMBL11423 | 0.89 | TSHR (0.42) | TSHRNAPRTTDP1 | |
| Pyridazine SCHEMBL29471424 | 0.89 | — | — | |
| Pyridazine SCHEMBL27261743 | 0.86 | — | — | |
| Pyridazine SCHEMBL21626119 | 0.84 | TSHR (0.39) | TSHRNAPRTTDP1 | |
| Pyridazine SCHEMBL21222853 | 0.84 | — | — | |
| Pyridazine SCHEMBL20568253 | 0.84 | — | — | |
| Pyridazine SCHEMBL21405425 | 0.84 | — | — | |
| Pyridazine SCHEMBL1291979 | 0.84 | — | — | |
| Pyridazine SCHEMBL8987981 | 0.84 | — | — |
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-110049780-A | Isoquinolinebenzodiazepine (IQB) -1 (chloromethyl) -2, 3-dihydro-1H-benzo [ E ] indole (CBI) dimer | 塞勒兰特治疗公司 | 2019-07-23 | — | — | CN | disclosed |