Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 4/20 | 0.35 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL8442059 | 0.82 | ALDH1A1 (0.41) | ALDH1A1THRBTSHR | |
| SCHEMBL7927406 | 0.76 | ALDH1A1 (0.52) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL347723 | 0.75 | ALDH1A1 (0.42) | ALDH1A1THRBTSHRTDP1 | |
| Ammonia Solution, Strong SCHEMBL1735564 | 0.74 | ALDH1A1 (0.41) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL9781145 | 0.74 | THRB (0.44) | ALDH1A1THRBTSHR | |
| Hydrochloric Acid SCHEMBL28854121 | 0.74 | ALDH1A1 (0.41) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL1251932 | 0.71 | TSHR (0.47) | ALDH1A1TSHRTDP1 | |
| SCHEMBL27714434 | 0.69 | ALDH1A1 (0.41) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL16944261 | 0.69 | THRB (0.44) | ALDH1A1THRBTSHRTDP1 | |
| SCHEMBL9747107 | 0.69 | ALDH1A1 (0.44) | ALDH1A1THRBTSHRTDP1 |
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-5998646-A | Unsaturated organometallic compounds derived from titanium and process for their preparation | ELF ATOCHEM S.A. (FR) | 1999-12-07 | — | — | US | disclosed |