Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 2/20 | 0.42 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.42 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | GNAI3 | P08754 | 6/20 | 0.41 |
| ▸ | GNAO1 | P09471 | 6/20 | 0.41 |
| ▸ | GNAI1 | P63096 | 6/20 | 0.41 |
| ▸ | GUSB | P08236 | 2/20 | 0.40 |
| ▸ | EBP | Q15125 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 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 | |
|---|---|---|---|---|
| SCHEMBL19710786 | 0.77 | GNAI3 (0.45) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL38666415 | 0.77 | GNAI3 (0.45) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL19275195 | 0.77 | GNAI3 (0.45) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL20746972 | 0.77 | GNAI3 (0.45) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL27317078 | 0.72 | GNAI3 (0.41) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL25653853 | 0.72 | S1PR1 (0.44) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL24261257 | 0.71 | S1PR1 (0.49) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL25834628 | 0.71 | GNAI3 (0.44) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL17350998 | 0.71 | S1PR1 (0.49) | S1PR1S1PR3S1PR5S1PR4GNAI3 | |
| SCHEMBL19710757 | 0.71 | S1PR1 (0.49) | S1PR1S1PR3S1PR5S1PR4GNAI3 |
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-7145003-B1 | Process for synthesizing 1,5 dinosyl-3,3,7,7-tetrakis(difluoramino)octahydro-1,5-diazocine (DNTDFD) | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRECTARY OF THE NAVY (US) | 2006-12-05 | — | — | US | claimed |
| US-7145003-B1 | Process for synthesizing 1,5 dinosyl-3,3,7,7-tetrakis(difluoramino)octahydro-1,5-diazocine (DNTDFD) | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRECTARY OF THE NAVY (US) | 2006-12-05 | — | — | US | disclosed |