Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | FAAH | O00519 | 2/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL8153584 | 0.84 | MAPK1 (0.51) | ALDH1A1KMT2AMEN1MAPTLMNA | |
| SCHEMBL8153502 | 0.76 | AR (0.35) | KDM4EFAAHMGLLMAPTLMNA | |
| SCHEMBL11520897 | 0.75 | ALDH1A1 (0.41) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL10797745 | 0.73 | TDP1 (0.44) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL11514849 | 0.71 | ALDH1A1 (0.44) | ALDH1A1KDM4EKMT2AMAPTLMNA | |
| SCHEMBL7438153 | 0.70 | CYP2C19 (0.71) | ALDH1A1KDM4ECNR2MAPTLMNA | |
| SCHEMBL3960771 | 0.70 | KMT2A (0.53) | ALDH1A1KMT2AMEN1NR3C1CYP2C19 | |
| SCHEMBL11513433 | 0.69 | ALDH1A1 (0.42) | ALDH1A1KDM4EKMT2AMAPTGAA | |
| SCHEMBL10537929 | 0.69 | VCAM1 (0.46) | ALDH1A1KDM4EKMT2AMEN1MAPT | |
| SCHEMBL3962558 | 0.69 | KMT2A (0.46) | ALDH1A1KDM4EFAAHMGLLKMT2A |
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-6137009-A | ADMIXING MONOALKYLAMINE, ALKALI, AND 2-HALO-6-HALO-BENZYL HALIDE; HEATING TO FORM N-ALKYL-2-HALO-6-HALO-BENZYLAMINE AND SALT | SRM CHEMICAL, LTD. CO. (US) | 2000-10-24 | — | — | US | disclosed |