Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | TERT | O14746 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL11535775 | 0.89 | ABCB1 (0.56) | CYP1A2CYP3A4ADRA2BADRA1AABCB1 | |
| SCHEMBL11738951 | 0.85 | CYP1A2 (0.53) | MAOBTDP1CYP1A2CYP3A4TSHR | |
| SCHEMBL11816886 | 0.85 | TDP1 (0.44) | TDP1CYP1A2CYP3A4TSHRADRA2B | |
| SCHEMBL11737033 | 0.84 | TDP1 (0.56) | MAOBTDP1CYP1A2CYP3A4TSHR | |
| SCHEMBL11739860 | 0.84 | TOP2A (0.46) | TDP1CYP1A2CYP3A4TSHRADRA2B | |
| SCHEMBL11734295 | 0.81 | TDP1 (0.58) | MAOBTDP1CYP1A2CYP3A4TSHR | |
| SCHEMBL11738830 | 0.80 | ABCB1 (0.53) | TDP1CYP1A2CYP3A4ABCB1SMPD1 | |
| SCHEMBL11748982 | 0.79 | ABCB1 (0.60) | MAOBCYP1A2CYP3A4TSHRADRA2B | |
| SCHEMBL11729888 | 0.78 | MAOB (0.40) | MAOBTDP1ACHETERTALOX15 | |
| SCHEMBL11735706 | 0.77 | TDP1 (0.59) | MAOBTDP1CYP1A2CYP3A4TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4031219-A | ANTIARRHYTHYMICS | BOEHRINGER INGELHEIM GMBH (DT) | 1977-06-21 | — | — | US | disclosed |