Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GGPS1 | O95749 | 6/20 | 0.35 |
| ▸ | SMPD1 | P17405 | 5/20 | 0.35 |
| ▸ | FDPS | P14324 | 9/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.33 |
| ▸ | LPAR3 | Q9UBY5 | 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 | |
|---|---|---|---|---|
| SCHEMBL11027024 | 0.96 | CA1 (0.35) | GGPS1SMPD1FDPSCES2LPAR1 | |
| SCHEMBL11252285 | 0.96 | CA1 (0.35) | GGPS1SMPD1FDPSCES2LPAR1 | |
| SCHEMBL11234914 | 0.92 | CA1 (0.35) | CES2LPAR1LPAR3 | |
| SCHEMBL11048467 | 0.76 | NAAA (0.36) | CES2LPAR1LPAR3 | |
| SCHEMBL14777506 | 0.72 | TSHR (0.40) | GGPS1SMPD1FDPSCES2LPAR1 | |
| SCHEMBL10011526 | 0.71 | CYP3A4 (0.38) | — | |
| SCHEMBL14778355 | 0.70 | TSHR (0.38) | GGPS1SMPD1FDPSCES2LPAR1 | |
| SCHEMBL14778504 | 0.70 | TSHR (0.38) | GGPS1SMPD1FDPSCES2LPAR1 | |
| SCHEMBL14778437 | 0.70 | TSHR (0.38) | GGPS1SMPD1FDPSCES2LPAR1 | |
| SCHEMBL14778045 | 0.70 | TSHR (0.38) | GGPS1SMPD1FDPSCES2LPAR1 |
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-4473710-A | REACTION WITH A HALOGENOMETHYL DERIVATIVE IB THE PRESENCE OF A PHASE TRANSFER CATALYST | SOCIETE NATIONALE DES POUDRES ET EXPLOSIFS (FR) | 1984-09-25 | — | — | US | disclosed |