Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | LTA4H | P09960 | 2/20 | 0.44 |
| ▸ | KIF11 | P52732 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| Trifluoromethylbenzene SCHEMBL28057959 | 0.86 | TSHR (0.64) | ALDH1A1TSHRKIF11CES2CES1 | |
| Trifluoromethylbenzene SCHEMBL28195950 | 0.84 | TSHR (0.67) | ALDH1A1TSHRKIF11PTGDR2TACR1 | |
| Tert-Butylbenzene SCHEMBL7124304 | 0.83 | LTA4H (0.46) | ALDH1A1TSHRLTA4HHPGDTP53 | |
| SCHEMBL16367918 | 0.81 | CES1 (0.49) | ALDH1A1TSHRLTA4HCES2CES1 | |
| SCHEMBL1722311 | 0.81 | CES1 (0.49) | ALDH1A1TSHRLTA4HCES2CES1 | |
| Ammonia Solution, Strong SCHEMBL1723857 | 0.80 | CES1 (0.47) | ALDH1A1TSHRLTA4HCES2CES1 | |
| Trifluoromethylbenzene SCHEMBL6391221 | 0.79 | TSHR (0.54) | ALDH1A1TSHRKIF11CES2CES1 | |
| Trifluoromethylbenzene SCHEMBL27930053 | 0.79 | TSHR (0.54) | ALDH1A1TSHRLTA4HKIF11PTGDR2 | |
| Tetrabuthylammonium SCHEMBL28169984 | 0.79 | TSHR (0.54) | ALDH1A1TSHRKIF11TP53CYP3A4 | |
| SCHEMBL20654847 | 0.79 | TSHR (0.42) | ALDH1A1TSHRLTA4HPTGDR2HPGD |
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-5082921-A | Benzotrifluoride aryl ether polymer | THE DOW CHEMICAL COMPANY (US) | 1992-01-21 | — | — | US | claimed |
| US-5030252-A | Polytarylene ethers; permselectivity | THE DOW CHEMICAL COMPANY (US) | 1991-07-09 | — | — | US | claimed |
| US-5082921-A | Benzotrifluoride aryl ether polymer | THE DOW CHEMICAL COMPANY (US) | 1992-01-21 | — | — | US | disclosed |
| US-5082921-A | Benzotrifluoride aryl ether polymer | THE DOW CHEMICAL COMPANY (US) | 1992-01-21 | — | — | US | disclosed |
| US-5082921-A | Benzotrifluoride aryl ether polymer | THE DOW CHEMICAL COMPANY (US) | 1992-01-21 | — | — | US | disclosed |
| US-5030252-A | Polytarylene ethers; permselectivity | THE DOW CHEMICAL COMPANY (US) | 1991-07-09 | — | — | US | disclosed |
| US-5030252-A | Polytarylene ethers; permselectivity | THE DOW CHEMICAL COMPANY (US) | 1991-07-09 | — | — | US | disclosed |
| US-5030252-A | Polytarylene ethers; permselectivity | THE DOW CHEMICAL COMPANY (US) | 1991-07-09 | — | — | US | disclosed |