Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LTA4H | P09960 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.36 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8693211 | 0.99 | BLM (0.43) | LTA4HCYP1A2CYP3A4CYP2C19BLM | |
| SCHEMBL8692202 | 0.89 | LTA4H (0.42) | LTA4HCYP1A2CYP3A4CYP2C19BLM | |
| Hydrochloric Acid SCHEMBL9028510 | 0.88 | KCNH2 (0.36) | HRH3ACHESIGMAR1MEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8691117 | 0.88 | LTA4H (0.41) | LTA4HCYP1A2CYP3A4CYP2C19BLM | |
| SCHEMBL8690690 | 0.86 | KDM4E (0.48) | HRH3MEN1LMNAKMT2ACHRNB2 | |
| Hydrochloric Acid SCHEMBL8691258 | 0.85 | KDM4E (0.47) | HRH3MEN1LMNAKMT2A | |
| SCHEMBL7397373 | 0.81 | LTA4H (0.47) | LTA4HHRH3CHRNB2CHRNB4CHRNA3 | |
| Hydrochloric Acid SCHEMBL7404107 | 0.81 | LTA4H (0.46) | LTA4HHRH3SIGMAR1CHRNB2CHRNB4 | |
| SCHEMBL8691890 | 0.76 | KDM4E (0.44) | HRH3MEN1LMNAKMT2A | |
| SCHEMBL8694229 | 0.75 | SLC6A2 (0.35) | CYP1A2CYP3A4CYP2C19BLMPMP22 |
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-5760035-A | PIPERIDINE COMPOUNDS SUBSTITUTED WITH AN AMINOALKYL GROUP AND AN ARYLOXYALKYL GROUP, ANTIALLERGENS, ANTIINFLAMMATORY AGENTS, IMMUNOSUPPRESSANTS | KNOLL AKTIENGESELLSCHAFT (DE) | 1998-06-02 | — | — | US | disclosed |