Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FDPS | P14324 | 6/20 | 0.42 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GGPS1 | O95749 | 2/20 | 0.34 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.34 |
| ▸ | TNNC1 | P63316 | 5/20 | 0.34 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.34 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.34 |
| ▸ | SGPL1 | O95470 | 1/20 | 0.34 |
| ▸ | GPR183 | P32249 | 1/20 | 0.34 |
| ▸ | CERS2 | Q96G23 | 1/20 | 0.34 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8998092 | 0.93 | FDPS (0.40) | FDPSSMPD1TSHRSPHK1TNNC1 | |
| SCHEMBL3798895 | 0.84 | FDPS (0.41) | FDPSSMPD1GGPS1SPHK1 | |
| SCHEMBL7106475 | 0.82 | FDPS (0.42) | FDPSSMPD1TSHRGGPS1SPHK1 | |
| SCHEMBL2351408 | 0.82 | TSHR (0.39) | TSHR | |
| Bromide SCHEMBL9716432 | 0.81 | SPHK1 (0.44) | FDPSSMPD1GGPS1SPHK1 | |
| Hydrochloric Acid SCHEMBL9635702 | 0.81 | SPHK1 (0.44) | FDPSSMPD1GGPS1SPHK1 | |
| SCHEMBL4448029 | 0.79 | FDPS (0.47) | FDPSSMPD1TSHRGGPS1SPHK1 | |
| SCHEMBL11611964 | 0.78 | SPHK1 (0.45) | FDPSSMPD1SPHK1 | |
| SCHEMBL3856250 | 0.77 | FDPS (0.39) | FDPSSMPD1SPHK1 | |
| SCHEMBL5191501 | 0.77 | FDPS (0.39) | FDPSSMPD1GGPS1SPHK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0519747-B1 | Cement admixture and defoaming agent | GRACE W R & CO (US) | 1996-09-04 | — | — | EP | disclosed |
| EP-0519747-A2 | Cement admixture and defoaming agent | W.R. Grace & Co.-Conn. (US) | 1992-12-23 | — | — | EP | disclosed |
| US-5156679-A | Water soluble alkylated alkanolamine salts | W. R. GRACE & CO.-CONN. (US) | 1992-10-20 | — | — | US | disclosed |