Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 2/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | FNTA | P49354 | 1/20 | 0.44 |
| ▸ | FNTB | P49356 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL27874470 | 0.98 | CES1 (0.50) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL5150815 | 0.81 | HDAC8 (0.57) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL7527957 | 0.80 | CES2 (0.48) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL28295321 | 0.80 | L3MBTL1 (0.54) | CES1CES2AKR1B1MEN1KMT2A | |
| Methyl Alcohol SCHEMBL11054071 | 0.80 | CES1 (0.64) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL51367 | 0.80 | CES1 (0.64) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL77563 | 0.79 | CES1 (0.70) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL16488475 | 0.79 | CES1 (0.52) | CES1CES2AKR1B1MEN1KMT2A | |
| SCHEMBL4582402 | 0.79 | CES1 (0.52) | CES1CES2AKR1B1MEN1KMT2A | |
| Dimethylamine SCHEMBL3684568 | 0.79 | CES1 (0.52) | CES1CES2AKR1B1MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6984738-B2 | Process for production of optically active amino alcohols | YOKOZAWA TOHRU | 2006-01-10 | — | — | US | claimed |
| CN-111153816-A | Preparation method of tomoxetine | 北京万全德众医药生物技术有限公司 | 2020-05-15 | — | — | CN | disclosed |
| CN-111153816-A | Preparation method of tomoxetine | 北京万全德众医药生物技术有限公司 | 2020-05-15 | — | — | CN | disclosed |
| WO-2005118524-A1 | PROCESS FOR PREPARING [(S)-(-)ALPHA-METHYLAMINO PHENYLACETONE]2 (2R, 3R)-TARTARIC ACID DERIVATES | SHANGHAI INSTITUTE OF PHARMACEUTICAL INDUSTRY (CN) | 2005-12-15 | — | — | WO | disclosed |
| CN-1265391-A | Preparation of levorotary Alpha-methylamino-phenylacetone and repeated usage of separating agent | LI JIANFU (CN) | 2000-09-06 | — | — | CN | disclosed |