Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.40 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.39 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8900069 | 0.86 | KDM4E (0.39) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| SCHEMBL8897692 | 0.83 | PARP1 (0.33) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| SCHEMBL8896415 | 0.81 | PARP1 (0.35) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| SCHEMBL8899737 | 0.80 | PARP1 (0.35) | MEN1KMT2ARPS6KB1PARP1ALDH1A1 | |
| SCHEMBL8898159 | 0.80 | CYP3A4 (0.42) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| Hydrochloric Acid SCHEMBL30217966 | 0.79 | CYP3A4 (0.37) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| SCHEMBL8898563 | 0.78 | KMT2A (0.35) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| SCHEMBL3693342 | 0.78 | CYP3A4 (0.49) | CYP3A4NR1I2LMNAMEN1CHRM2 | |
| SCHEMBL10936470 | 0.78 | ALDH1A1 (0.50) | CYP3A4NR1I2MEN1KMT2APRSS1 | |
| SCHEMBL16469561 | 0.78 | CYP3A4 (0.43) | CYP3A4NR1I2LMNAMEN1CHRM2 |
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-5703091-A | N-substituted azabicycloalkane derivatives, their preparation and use | BASF AKTIENGESELLSCHAFT (DE) | 1997-12-30 | — | — | US | disclosed |