Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CLK2 | P49760 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | STAT3 | P40763 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9668175 | 0.86 | ADRB2 (0.60) | ADRB2KCNH2KDM4EHPGDCYP2C19 | |
| SCHEMBL9276997 | 0.83 | ADRB2 (0.55) | ADRB2KCNH2KDM4EHPGDCYP2C19 | |
| SCHEMBL10914492 | 0.83 | ADRB2 (0.58) | ADRB2KCNH2KDM4EHPGDCYP2C19 | |
| SCHEMBL9668649 | 0.82 | ADRB2 (0.57) | ADRB2KCNH2KDM4EHPGDCYP2C19 | |
| SCHEMBL29492858 | 0.81 | ADRB2 (0.68) | ADRB2KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL2844967 | 0.81 | ADRB2 (0.68) | ADRB2KCNH2KDM4EHPGDALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL8741059 | 0.81 | ADRB2 (0.51) | ADRB2KCNH2KDM4EHPGDCYP2C19 | |
| Trifluoroacetic Acid SCHEMBL8741058 | 0.81 | ADRB2 (0.51) | ADRB2KCNH2KDM4EHPGDCYP2C19 | |
| SCHEMBL7131518 | 0.81 | ADRB2 (0.59) | ADRB2KCNH2KDM4EHPGDALDH1A1 | |
| SCHEMBL6784057 | 0.81 | KCNH2 (0.66) | ADRB2KCNH2KDM4EHPGDCYP2C19 |
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-4927926-A | BACTERICIDES | LABORATORIOS DEL DR. ESTEVE S.A. (ES) | 1990-05-22 | — | — | US | disclosed |