Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8536680 | 1.00 | KDM4E (0.42) | KDM4EALDH1A1SMN1; SMN2HTTADRA1A | |
| SCHEMBL30111657 | 0.79 | TSHR (0.50) | ALDH1A1HTTADRA1AADRA1BRAB9A | |
| SCHEMBL109178 | 0.79 | TSHR (0.50) | ALDH1A1HTTADRA1AADRA1BRAB9A | |
| SCHEMBL8536616 | 0.78 | ALDH1A1 (0.50) | KDM4EALDH1A1SMN1; SMN2HTTRAB9A | |
| SCHEMBL8536613 | 0.78 | ALDH1A1 (0.50) | KDM4EALDH1A1SMN1; SMN2HTTRAB9A | |
| SCHEMBL14628673 | 0.77 | ALDH1A1 (0.42) | KDM4EALDH1A1SMN1; SMN2TAS1R3TAS1R1 | |
| Hydrogen Peroxide SCHEMBL29048859 | 0.77 | TSHR (0.48) | ALDH1A1HTTADRA1AADRA1BRAB9A | |
| SCHEMBL8536606 | 0.75 | EED (0.37) | KDM4EALDH1A1ADRA1AADRA1BTAS1R3 | |
| SCHEMBL8536607 | 0.75 | EED (0.37) | KDM4EALDH1A1ADRA1AADRA1BTAS1R3 | |
| SCHEMBL27872266 | 0.74 | TSHR (0.43) | ALDH1A1HTTADRA1AADRA1BRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0885869-A1 | THERAPEUTIC AGENT FOR DIABETES | Japan Tobacco Inc. (JP) | 1998-12-23 | — | — | EP | disclosed |