Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | ACHE | P22303 | 3/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.31 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.30 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8745400 | 0.82 | TSHR (0.43) | TSHRLMNAALDH1A1 | |
| Hydrochloric Acid SCHEMBL2154232 | 0.80 | TSHR (0.41) | TSHRLMNAALDH1A1 | |
| SCHEMBL11311009 | 0.78 | ACHE (0.39) | TSHRLMNAACHEALOX12TDP1 | |
| SCHEMBL246944 | 0.77 | TSHR (0.53) | TSHRLMNAALDH1A1ADRB2ADRB1 | |
| SCHEMBL10079348 | 0.75 | ACHE (0.42) | TSHRLMNARAB9ANPC1ACHE | |
| SCHEMBL8004958 | 0.75 | ACHE (0.35) | TSHRLMNAACHEALOX12TDP1 | |
| Hydrochloric Acid SCHEMBL2155084 | 0.74 | TSHR (0.50) | TSHRLMNAALDH1A1ADRB2ADRB1 | |
| SCHEMBL2933392 | 0.72 | ACHE (0.53) | TSHRLMNARAB9ANPC1ACHE | |
| SCHEMBL5401678 | 0.72 | CYP2A6 (0.43) | TSHRRAB9ANPC1TDP1L3MBTL1 | |
| SCHEMBL11312200 | 0.72 | GABRA1 (0.34) | TSHRLMNARAB9ANPC1ACHE |
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 |
|---|---|---|---|---|---|---|---|
| CN-117924561-A | Transition metal catalyst, preparation method thereof, intermediate and application | 中国石油化工股份有限公司 | 2024-04-26 | — | — | CN | disclosed |
| US-6031066-A | POLYMERIZING ALPHA, BETA-UNSATURATED CARBOXYLIC ACID ESTER CONTAINING A TERTIARY AMINO GROUP AS A POLYMERIZABLE MONOMER IN THE PRESENCE OF A PHOSPHORUS COMPOUND | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2000-02-29 | — | — | US | disclosed |