Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 5/20 | 0.66 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.66 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.66 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.66 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.66 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.66 |
| ▸ | HTR2A | P28223 | 2/20 | 0.66 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.66 |
| ▸ | ACHE | P22303 | 1/20 | 0.66 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | SQLE | Q14534 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9722139 | 0.85 | CYP2D6 (0.71) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| SCHEMBL18589310 | 0.83 | CYP2D6 (0.56) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| SCHEMBL9722006 | 0.83 | CYP2D6 (0.67) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| SCHEMBL9722047 | 0.81 | CYP2D6 (0.64) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| SCHEMBL10748607 | 0.81 | CYP2D6 (0.43) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| Butenafine SCHEMBL20456391 | 0.80 | CYP2D6 (1.00) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| Butenafine SCHEMBL29354083 | 0.80 | CYP2D6 (1.00) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| Butenafine SCHEMBL65526 | 0.80 | CYP2D6 (1.00) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| Butenafine SCHEMBL262301 | 0.79 | LMNA (0.97) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A | |
| Butenafine SCHEMBL676912 | 0.79 | LMNA (0.97) | LMNACYP2D6SLC6A2SIGMAR1ADRA2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0221781-B1 | BENZYLAMINE DERIVATIVES, PROCESS FOR PRODUCTION THEREOF, AND USE THEREOF | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1991-05-02 | — | — | EP | disclosed |
| US-4822822-A | FUNGICIDES FOR PLANTS AND ANIMALS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1989-04-18 | — | — | US | disclosed |