Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 4/20 | 0.40 |
| ▸ | S1PR3 | Q99500 | 4/20 | 0.40 |
| ▸ | S1PR2 | O95136 | 3/20 | 0.40 |
| ▸ | S1PR5 | Q9H228 | 3/20 | 0.40 |
| ▸ | NPY4R | P50391 | 3/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA3 | P07451 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CA6 | P23280 | 1/20 | 0.35 |
| ▸ | CA5A | P35218 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.35 |
| ▸ | RRM1 | P23921 | 1/20 | 0.33 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.32 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.32 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL8920678 | 1.00 | S1PR1 (0.40) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| SCHEMBL526842 | 0.93 | RRM1 (0.38) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| SCHEMBL8778917 | 0.93 | RRM1 (0.38) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8924641 | 0.91 | S1PR1 (0.40) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8919599 | 0.91 | S1PR1 (0.40) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8920249 | 0.89 | NPY4R (0.38) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8921713 | 0.89 | NPY4R (0.38) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8919616 | 0.88 | NPY4R (0.39) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8919832 | 0.88 | NPY4R (0.39) | S1PR1S1PR3S1PR2S1PR5NPY4R | |
| Trifluoroacetic Acid SCHEMBL8921920 | 0.88 | NPY4R (0.39) | S1PR1S1PR3S1PR2S1PR5NPY4R |
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-5637613-A | ANTITUMOR AGENT; IMMUNOSUPPRESSANTS | FOURNIER INDUSTRIE ET SANTE (FR) | 1997-06-10 | — | — | US | disclosed |