Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.38 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.38 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.38 |
| ▸ | SLC22A3 | O75751 | 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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL28396424 | 0.98 | MAOA (0.41) | MAOAMAOBMEN1KMT2ACA1 | |
| SCHEMBL5119190 | 0.78 | TAAR1 (0.43) | MAOAMAOBMEN1KMT2ACA1 | |
| SCHEMBL1462548 | 0.78 | LMNA (0.40) | MAOAMAOBMEN1KMT2ACA1 | |
| SCHEMBL29240594 | 0.76 | MAPT (0.43) | MAOAMAOBMEN1KMT2ACA1 | |
| SCHEMBL29009281 | 0.76 | MEN1 (0.40) | MAOAMAOBMEN1KMT2ACA1 | |
| SCHEMBL12835038 | 0.76 | MAOB (0.41) | MAOAMAOBMEN1KMT2AALDH1A1 | |
| SCHEMBL7306942 | 0.76 | CA1 (0.52) | MAOACA1CA2CA9ALDH1A1 | |
| SCHEMBL81261 | 0.76 | MEN1 (0.52) | MAOAMAOBMEN1KMT2ACA1 | |
| SCHEMBL11485695 | 0.76 | LMNA (0.52) | MEN1KMT2ACA1CA2CA9 | |
| SCHEMBL7308175 | 0.76 | HSP90AA1 (0.46) | MEN1KMT2AALDH1A1IDO1MAPT |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114149353-B | N-alkyl/N-aryl thioamide derivatives, and synthetic method and application thereof | 华东师范大学 | 2024-05-17 | — | — | CN | disclosed |
| CN-112961087-A | Preparation process of high-yield phenyl isothiocyanate derivative | 刘科技 | 2021-06-15 | — | — | CN | disclosed |
| CN-112939833-A | High-yield production process of phenyl isothiocyanate derivative | 刘科技 | 2021-06-11 | — | — | CN | disclosed |
| CN-110845379-A | Preparation method of phenyl isothiocyanate derivative | 刘科技 | 2020-02-28 | — | — | CN | disclosed |
| CN-1847224-A | Process of synthesizing thiocarbamate from aniline | DALIAN INST OF CHEMCIAL PHYSIC (CN) | 2006-10-18 | — | — | CN | disclosed |
| CN-1814588-A | Method for synthesizing thiocurbamate from aromatic nitro compound | DALIAN CHEMICAL PHYSICS INST (CN) | 2006-08-09 | — | — | CN | disclosed |
| CN-1721402-A | A kind of method of synthesizing thiocarbamate | DALIAN CHEMICAL PHYSICS INST (CN) | 2006-01-18 | — | — | CN | disclosed |