Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.73 |
| ▸ | TSHR | P16473 | 2/20 | 0.73 |
| ▸ | LMNA | P02545 | 2/20 | 0.73 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.73 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 2/20 | 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 | |
|---|---|---|---|---|
| Toluene SCHEMBL10606497 | 0.93 | ACHE (0.73) | ACHETSHRLMNAALOX12CES2 | |
| Toluene SCHEMBL6889473 | 0.93 | ACHE (0.73) | ACHETSHRLMNAALOX12CES2 | |
| Toluene SCHEMBL4415822 | 0.93 | ACHE (0.73) | ACHETSHRLMNAALOX12CES2 | |
| Toluene SCHEMBL11041753 | 0.93 | ACHE (0.73) | ACHETSHRLMNAALOX12CES2 | |
| Toluene SCHEMBL10346299 | 0.93 | ACHE (0.73) | ACHETSHRLMNAALOX12CES2 | |
| Toluene SCHEMBL11313266 | 0.89 | ACHE (0.92) | ACHETSHRLMNAALOX12CES2 | |
| Toluene SCHEMBL9833169 | 0.89 | — | — | |
| Toluene SCHEMBL29165211 | 0.86 | — | — | |
| Toluene SCHEMBL8546810 | 0.86 | — | — | |
| Toluene SCHEMBL28196488 | 0.86 | ACHE (0.85) | ACHETSHRLMNAALOX12CES2 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4180692-A | AROMATIC MOLYBDENUM TRICARBONYL AS CATALYST | THE UNIVERSITY OF AKRON (US) | 1979-12-25 | — | — | US | claimed |
| US-4291143-A | Polymerization of unsaturated hydrocarbyl halide compounds | UOP INC. (US) | 1981-09-22 | — | — | US | disclosed |
| US-4180692-A | AROMATIC MOLYBDENUM TRICARBONYL AS CATALYST | THE UNIVERSITY OF AKRON (US) | 1979-12-25 | — | — | US | disclosed |
| US-4038324-A | FRIEDEL-CRAFTS REACTIONS, ARENE-METAL TRICARBONYL CATALYST | THE UNIVERSITY OF AKRON (US) | 1977-07-26 | — | — | US | disclosed |
| US-3992418-A | Production of pyromellitic dianhydride | UNIVERSAL OIL PRODUCTS COMPANY (US) | 1976-11-16 | — | — | US | disclosed |
| US-3984483-A | FRIEDEL-CRAFTS REACTION | THE UNIVERSITY OF AKRON (US) | 1976-10-05 | — | — | US | disclosed |
| US-3946072-A | ARENE-METAL TRICARBONYL COMPLEXES AS CATALYSTS, ALKYLATION, ACYLATION | THE UNIVERSITY OF AKRON (US) | 1976-03-23 | — | — | US | disclosed |
| US-3933752-A | COPOLYMERIZATION USING ARENE-METAL TRICARBONYL FRIEDEL-CRAFTS CATALYSTS | THE UNIVERSITY OF AKRON (US) | 1976-01-20 | — | — | US | disclosed |