Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL11249700 | 0.83 | HTR2B (0.47) | ADRA2ALMNACYP2D6HIF1AMEN1 | |
| SCHEMBL11246671 | 0.79 | ADRA2A (0.36) | ADRA2ALMNACYP2D6HIF1AMEN1 | |
| SCHEMBL11239762 | 0.79 | ADRA2A (0.36) | ADRA2ALMNACYP2D6HIF1AMEN1 | |
| SCHEMBL11242343 | 0.79 | ADRA2A (0.36) | ADRA2ALMNACYP2D6HIF1AMEN1 | |
| SCHEMBL5179498 | 0.70 | ALDH1A1 (0.40) | LMNACYP2D6HIF1AKMT2ABLM | |
| SCHEMBL11247894 | 0.68 | TSHR (0.42) | MEN1KMT2ATSHRCXCL8ALDH1A1 | |
| SCHEMBL11241971 | 0.68 | ALDH1A1 (0.41) | MEN1KMT2APOLBCYP1A2TSHR | |
| SCHEMBL11247962 | 0.68 | GLS (0.40) | LMNAMEN1KMT2AMAPTPOLB | |
| SCHEMBL9274763 | 0.66 | PDK1 (0.39) | NPC1RAB9ALMNAMEN1MAPK1 | |
| SCHEMBL9125705 | 0.66 | KMT2A (0.40) | GAACYP2D6HIF1AMEN1CYP3A4 |
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-4318915-A | Substituted guandines and methods of preparation thereof | BEIERSDORF AKTIENGESELLSCHAFT (DE) | 1982-03-09 | — | — | US | disclosed |