Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | PRKACA | P17612 | 1/20 | 0.37 |
| ▸ | PRKACG | P22612 | 1/20 | 0.37 |
| ▸ | PRKACB | P22694 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CHUK | O15111 | 1/20 | 0.36 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.35 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL1993550 | 0.98 | HRH4 (0.40) | CYP1A2CYP2C19HRH4MEN1KMT2A | |
| SCHEMBL18135535 | 0.82 | HRH4 (0.46) | HRH4SMN1; SMN2USP2TDP1ALDH1A1 | |
| SCHEMBL5175874 | 0.80 | GAA (0.53) | CYP1A2MEN1KMT2ASMN1; SMN2CRHBP | |
| Hydrochloric Acid SCHEMBL16825844 | 0.80 | HRH4 (0.44) | HRH4SMN1; SMN2USP2TDP1LMNA | |
| SCHEMBL16825884 | 0.74 | TSHR (0.50) | CYP2C19MEN1KMT2AACHECHUK | |
| SCHEMBL16825863 | 0.74 | AKT2 (0.41) | HRH4 | |
| SCHEMBL16825689 | 0.72 | NEK2 (0.47) | CYP2C19MEN1KMT2AUSP2LMNA | |
| Hydrochloric Acid SCHEMBL16826300 | 0.71 | NEK2 (0.46) | CYP2C19MEN1KMT2AUSP2LMNA | |
| SCHEMBL16826410 | 0.70 | GAA (0.62) | MEN1KMT2AUSP2MAPTLMNA | |
| SCHEMBL16825972 | 0.70 | LMNA (0.51) | MEN1KMT2AUSP2MAPTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016099311-A1 | SUBSTITUTED AMINO TRIAZOLES USEFUL AS ACIDIC MAMMALIAN CHITINASE INHIBITORS | OncoArendi Therapeutics Sp. z o.o. (PL) | 2016-06-23 | — | — | WO | disclosed |