Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 5/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 6/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11144321 | 1.00 | CYP3A4 (0.37) | CYP3A4ADRA2ALMNAKDM4EALDH1A1 | |
| SCHEMBL11144562 | 0.83 | LMNA (0.43) | CYP3A4LMNAKDM4EALDH1A1HTT | |
| SCHEMBL11144559 | 0.83 | LMNA (0.43) | CYP3A4LMNAKDM4EALDH1A1HTT | |
| SCHEMBL11454683 | 0.81 | CYP3A4 (0.56) | CYP3A4ADRA2ALMNAKDM4EALDH1A1 | |
| SCHEMBL6067530 | 0.81 | CYP3A4 (0.56) | CYP3A4ADRA2ALMNAKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL11533363 | 0.79 | CYP3A4 (0.55) | CYP3A4ADRA2ALMNAKDM4EALDH1A1 | |
| SCHEMBL11148348 | 0.78 | NPC1 (0.44) | CYP3A4ADRA2ALMNAKDM4EALDH1A1 | |
| SCHEMBL11148344 | 0.78 | NPC1 (0.44) | CYP3A4ADRA2ALMNAKDM4EALDH1A1 | |
| SCHEMBL11145882 | 0.77 | CYP2C9 (0.38) | CYP3A4KDM4EALDH1A1HTTMAPT | |
| SCHEMBL11145290 | 0.77 | CYP2C9 (0.38) | CYP3A4KDM4EALDH1A1HTTMAPT |
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-4413013-A | N-(((ARYLFORMAMIDOYL)METHYLAMINO)THIO)-N-SUBSTITUTED SULFONAMIDES | THE UPJOHN COMPANY (US) | 1983-11-01 | — | — | US | disclosed |