Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 3/20 | 0.45 |
| ▸ | GLA | P06280 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 3/20 | 0.41 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.41 |
| ▸ | GPR88 | Q9GZN0 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL10990411 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10987249 | 0.83 | ALDH1A1 (0.50) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10984012 | 0.81 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10986954 | 0.80 | ALDH1A1 (0.47) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL9614327 | 0.79 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10987013 | 0.78 | NPC1 (0.51) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10984413 | 0.76 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10985942 | 0.75 | KMT2A (0.49) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL10736465 | 0.73 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2LMNATP53GLA | |
| SCHEMBL11287043 | 0.73 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2LMNATP53GLA |
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-4561879-A | Composition and method for combating weeds using an N-imidazolylmethyl halogenoacetanilide | BAYER AKTIENGESELLSCHAFT (DE) | 1985-12-31 | — | — | US | disclosed |
| US-4517011-A | N-substituted halogenoacetanilides and their use as herbicides | BAYER AKTIENGESELLSCHAFT (DE) | 1985-05-14 | — | — | US | disclosed |