Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | FUCA1 | P04066 | 2/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CCR3 | P51677 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | CTSG | P08311 | 1/20 | 0.40 |
| ▸ | CMA1 | P23946 | 1/20 | 0.40 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL7346143 | 0.92 | SIGMAR1 (0.41) | SIGMAR1FUCA1CHRM2CHRM4CHRM5 | |
| SCHEMBL7336258 | 0.87 | MC4R (0.42) | SIGMAR1FUCA1ACHEMAPT | |
| SCHEMBL1088536 | 0.83 | FUCA1 (0.60) | SIGMAR1FUCA1ACHECYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL1816800 | 0.81 | FUCA1 (0.58) | SIGMAR1FUCA1ACHECYP1A2CYP3A4 | |
| SCHEMBL7337561 | 0.81 | ALDH1A1 (0.44) | SIGMAR1ACHEALDH1A1S1PR5 | |
| Hydrochloric Acid SCHEMBL17375903 | 0.81 | FUCA1 (0.58) | SIGMAR1FUCA1ACHECYP1A2CYP3A4 | |
| SCHEMBL3604123 | 0.79 | SIGMAR1 (0.65) | SIGMAR1FUCA1ACHECYP1A2CYP3A4 | |
| SCHEMBL17304830 | 0.75 | FUCA1 (0.56) | SIGMAR1FUCA1ACHECYP1A2CYP3A4 | |
| SCHEMBL7345563 | 0.75 | KDM4E (0.50) | CHRM5ACHEALDH1A1 | |
| SCHEMBL7025144 | 0.75 | SIGMAR1 (0.49) | SIGMAR1CYP1A2CYP2D6CYP2C19ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4358599-A | Synthesis of 4-amino-1,2-hydrocarbyl pyrazolidines via 4-nitro analogs | A. H. ROBINS COMPANY, INC. (US) | 1982-11-09 | — | — | US | disclosed |
| US-4309552-A | Synthesis of 4-nitro-1,2-hydrocarbyl pyrazolidines and process for preparation thereof | A. H. ROBINS COMPANY, INC. (US) | 1982-01-05 | — | — | US | disclosed |