Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.48 |
| ▸ | DPP4 | P27487 | 1/20 | 0.43 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 11/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 5/20 | 0.39 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.39 |
| ▸ | SCN1A | P35498 | 1/20 | 0.36 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.36 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL4872510 | 0.86 | SIGMAR1 (0.60) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL4872520 | 0.86 | SIGMAR1 (0.60) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL4861131 | 0.86 | SIGMAR1 (0.60) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL2895322 | 0.81 | TDP1 (0.64) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL2895324 | 0.81 | TDP1 (0.64) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL944228 | 0.81 | TDP1 (0.60) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL2895326 | 0.81 | TDP1 (0.64) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL172785 | 0.81 | TDP1 (0.60) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL23170436 | 0.80 | TDP1 (0.58) | SIGMAR1TDP1EPHX2DPP4NR1H2 | |
| SCHEMBL13028980 | 0.79 | TDP1 (0.57) | SIGMAR1TDP1EPHX2DPP4NR1H2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1768966-B1 | COUMPOUNDS AND METHODS FOR INHIBITING THE INTERACTION OF BCL PROTEINS WITH BINDING PARTNERS | INFINITY DISCOVERY INC (US) | 2012-03-07 | — | — | EP | disclosed |