Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DNM1 | Q05193 | 3/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.34 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.34 |
| ▸ | LPAR3 | Q9UBY5 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 11/20 | 0.32 |
| ▸ | GGPS1 | O95749 | 7/20 | 0.32 |
| ▸ | SMPD1 | P17405 | 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 | |
|---|---|---|---|---|
| SCHEMBL23084856 | 0.98 | DNM1 (0.39) | DNM1CES2LPAR1LPAR3TSHR | |
| SCHEMBL30291001 | 0.88 | DNM1 (0.44) | DNM1CES2LPAR1LPAR3TSHR | |
| Bromide SCHEMBL31249480 | 0.86 | DNM1 (0.46) | DNM1CES2LPAR1LPAR3TSHR | |
| Bromide SCHEMBL30528224 | 0.86 | DNM1 (0.46) | DNM1CES2LPAR1LPAR3TSHR | |
| SCHEMBL28928935 | 0.85 | DNM1 (0.40) | DNM1CES2LPAR1LPAR3TSHR | |
| SCHEMBL3412334 | 0.82 | TSHR (0.35) | CES2LPAR1LPAR3TSHRTHRB | |
| SCHEMBL1262908 | 0.81 | LMNA (0.46) | CES2LPAR1LPAR3TSHRFDPS | |
| SCHEMBL10712746 | 0.80 | TSHR (0.40) | DNM1CES2LPAR1LPAR3TSHR | |
| SCHEMBL21291788 | 0.80 | TSHR (0.40) | DNM1CES2LPAR1LPAR3TSHR | |
| SCHEMBL23084849 | 0.80 | TSHR (0.40) | DNM1CES2LPAR1LPAR3TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6248885-B1 | 1. TERT-OCTYLDI-N-PROPLYLAMINE. 2. TERT-OCTYL-N-MORPHOLINE-BORANE. | SIGMA-ALDRICH CO. | 2001-06-19 | — | — | US | claimed |
| US-6248885-B1 | 1. TERT-OCTYLDI-N-PROPLYLAMINE. 2. TERT-OCTYL-N-MORPHOLINE-BORANE. | SIGMA-ALDRICH CO. | 2001-06-19 | — | — | US | disclosed |