Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | MPI | P34949 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL28638704 | 0.73 | GABRA1 (0.43) | TSHRCYP2C9TP53CYP3A4ALDH1A1 | |
| SCHEMBL836649 | 0.72 | — | — | |
| SCHEMBL30065450 | 0.72 | — | — | |
| SCHEMBL11559449 | 0.71 | GAA (0.54) | TSHRCYP2C9SMN1; SMN2MAPK1TP53 | |
| SCHEMBL17372822 | 0.71 | MEN1 (0.40) | MAPK1ALDH1A1POLBMPIMEN1 | |
| SCHEMBL9636666 | 0.71 | LMNA (0.48) | TSHRTDP1ESR1ESR2ALDH1A1 | |
| SCHEMBL28913620 | 0.71 | SMN1; SMN2 (0.54) | TSHRCYP2C9SMN1; SMN2MAPK1TP53 | |
| SCHEMBL4865789 | 0.71 | TSHR (0.57) | TSHRACHECYP2C9SMN1; SMN2MAPK1 | |
| SCHEMBL702526 | 0.71 | TSHR (0.53) | TSHRACHECYP2C9SMN1; SMN2MAPK1 | |
| SCHEMBL10813090 | 0.71 | TSHR (0.57) | TSHRACHECYP2C9SMN1; SMN2MAPK1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4567264-A | ADRENERGIC BLOCKING AGENTS | SYNTEX (U.S.A.) INC. (US) | 1986-01-28 | — | — | US | disclosed |
| US-4558129-A | Benzodioxanyl-hydroxyethylene-piperazinyl acetanilides which effect calcium entry and β-blockade | SYNTEX (U.S.A.) INC. (US) | 1985-12-10 | — | — | US | disclosed |
| US-4499100-A | CARDIOUVASCULAR DISORDERS | SYNTEX (U.S.A.) INC. (US) | 1985-02-12 | — | — | US | disclosed |
| EP-0126449-A1 | Cardioselective aryloxy- and arylthio-hydroxypropyl piperazinyl acetanilides wich affect calcium entry | SYNTEX (U.S.A.) INC. (US) | 1984-11-28 | — | — | EP | disclosed |
| US-4020012-A | IMPEGNATING CARRIER WITH TIN COMPOUND DISSOLVED IN ORGANO THIONYL SOLVENT | TOA NENRYO KOGYO KABUSHIKI KAISHA (JA) | 1977-04-26 | — | — | US | disclosed |