Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.43 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 2/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.41 |
| ▸ | KDM1A | O60341 | 1/20 | 0.41 |
| ▸ | CHKA | P35790 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7337561 | 0.77 | ALDH1A1 (0.44) | KDM4EALDH1A1TAAR1IDO1BCHE | |
| SCHEMBL2734780 | 0.77 | KDM4E (0.57) | KDM4EALDH1A1BCHEACHEBACE1 | |
| SCHEMBL28600653 | 0.77 | KDM4E (0.57) | KDM4EALDH1A1BCHEACHEBACE1 | |
| SCHEMBL25467280 | 0.76 | KDM4E (0.56) | KDM4EALDH1A1BCHEACHEBACE1 | |
| SCHEMBL22719602 | 0.76 | KDM4E (0.56) | KDM4EALDH1A1BCHEACHEBACE1 | |
| SCHEMBL6941820 | 0.76 | KDM4E (0.65) | KDM4EALDH1A1BCHEACHEBACE1 | |
| SCHEMBL8109237 | 0.76 | KDM4E (0.65) | KDM4EALDH1A1BCHEACHEBACE1 | |
| SCHEMBL7341302 | 0.75 | SIGMAR1 (0.46) | ALDH1A1ACHECHRM5 | |
| SCHEMBL30833207 | 0.73 | LTA4H (0.48) | KDM4EALDH1A1TAAR1IDO1BCHE | |
| SCHEMBL22731743 | 0.71 | KDM4E (0.59) | KDM4EALDH1A1BCHEACHEBACE1 |
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 |