Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL27591824 | 0.81 | AKR1C3 (0.52) | TSHRKMT2ARAB9AMEN1NPC1 | |
| Biphenyl SCHEMBL3255863 | 0.79 | TSHR (0.54) | TSHRKMT2AKCNN4RAB9ANPC1 | |
| Naphthalene SCHEMBL28307374 | 0.79 | TSHR (0.54) | TSHRKMT2AKCNN4RAB9AMEN1 | |
| Acetone SCHEMBL27771503 | 0.78 | AKR1C3 (0.48) | KMT2ARAB9AMEN1NPC1HTT | |
| Methoxymethane SCHEMBL28099062 | 0.78 | ALDH1A1 (0.53) | CA12CA1IDO1CA9ALDH1A1 | |
| Benzene SCHEMBL28156248 | 0.78 | TSHR (0.48) | TSHRKMT2AKCNN4RAB9ALMNA | |
| Phenol SCHEMBL25374179 | 0.77 | CA12 (0.58) | TSHRKMT2AKCNN4HTTLMNA | |
| Catechol SCHEMBL27621256 | 0.77 | TSHR (0.58) | TSHRKMT2AKCNN4RAB9AMEN1 | |
| Phenol SCHEMBL18603299 | 0.77 | CA12 (0.58) | TSHRKMT2AKCNN4HTTLMNA | |
| Bicarbonate SCHEMBL20918171 | 0.76 | TSHR (0.57) | TSHRKMT2AMEN1HTTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-114667630-A | Flame retardant for battery electrolytes | 雅宝公司 | 2022-06-24 | — | — | CN | disclosed |