Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL921115 | 1.00 | CA2 (0.41) | CA2TSHRTDP1CA5ACA5B | |
| 1,3-Propanediol SCHEMBL920408 | 0.87 | CA2 (0.37) | CA2TSHRTDP1 | |
| 1,4-Butanediol SCHEMBL924160 | 0.87 | CA2 (0.37) | CA2TSHRTDP1 | |
| SCHEMBL56331 | 0.84 | CA2 (0.54) | CA2TSHRTDP1CA5ACA5B | |
| SCHEMBL3781 | 0.84 | — | — | |
| 1,5-Pentanediol SCHEMBL923631 | 0.84 | GPR84 (0.38) | CA2TSHRTDP1 | |
| Monoethanolamine SCHEMBL28148822 | 0.84 | TSHR (0.47) | CA2TSHRTDP1CA5ACA5B | |
| SCHEMBL10495537 | 0.81 | CA2 (0.50) | CA2TSHRTDP1CA5ACA5B | |
| Water SCHEMBL10934974 | 0.81 | CA2 (0.50) | CA2TSHRTDP1CA5ACA5B | |
| Sulfuric Acid SCHEMBL560688 | 0.81 | CA5A (0.55) | CA2TSHRTDP1CA5ACA5B |
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-6607592-B1 | Antishrinkage agent for concrete or mortar | VICAT (FR) | 2003-08-19 | — | — | US | disclosed |