Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | SPHK1 | Q9NYA1 | 7/20 | 0.36 |
| ▸ | THRA | P10827 | 3/20 | 0.35 |
| ▸ | THRB | P10828 | 3/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.35 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL977352 | 0.89 | CA12 (0.37) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL977960 | 0.80 | CA12 (0.37) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL12923335 | 0.79 | S1PR1 (0.41) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL4357289 | 0.79 | HPGD (0.36) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL978421 | 0.78 | S1PR4 (0.37) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL3947095 | 0.77 | ACLY (0.39) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL12923378 | 0.76 | S1PR1 (0.44) | CA12CA1CA2CA9SPHK1 | |
| Trifluoroacetic Acid SCHEMBL978420 | 0.76 | S1PR1 (0.40) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL979245 | 0.76 | AKT1 (0.41) | CA12CA1CA2CA9SPHK1 | |
| SCHEMBL979710 | 0.75 | DRD2 (0.40) | CA12CA1CA2CA9THRA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009015485-A1 | CYCLIC INHIBITORS OF CARNITINE PALMITOYLTRANSFERASE AND TREATING CANCER | UNIVERSITY HEALTH NETWORK (CA) | 2009-02-05 | — | — | WO | disclosed |