Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.75 |
| ▸ | TP53 | P04637 | 1/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL5471371 | 1.00 | — | — | |
| Benzene SCHEMBL286680 | 1.00 | — | — | |
| Benzene SCHEMBL30503981 | 1.00 | TSHR (0.75) | TSHRTP53ALDH1A1NAPRTTDP1 | |
| SCHEMBL1086976 | 0.87 | TSHR (1.00) | TSHRTP53ALDH1A1NAPRTTDP1 | |
| Benzene SCHEMBL8430159 | 0.87 | TSHR (1.00) | TSHRTP53ALDH1A1NAPRTTDP1 | |
| SCHEMBL1112772 | 0.87 | TSHR (1.00) | TSHRTP53ALDH1A1NAPRTTDP1 | |
| Benzene SCHEMBL8576855 | 0.87 | TSHR (1.00) | TSHRTP53ALDH1A1NAPRTTDP1 | |
| Benzene SCHEMBL10780001 | 0.87 | TSHR (1.00) | TSHRTP53ALDH1A1NAPRTTDP1 | |
| Benzene SCHEMBL1330958 | 0.87 | — | — | |
| Benzene SCHEMBL8107103 | 0.87 | TSHR (1.00) | TSHRTP53ALDH1A1NAPRTTDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5223513-A | Anticholesterol agent | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-06-29 | — | — | US | disclosed |