Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASR | P41180 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | PROC | P04070 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4074503 | 0.82 | ALDH1A1 (0.47) | RAB9APOLBNPC1MAOBALDH1A1 | |
| SCHEMBL2861090 | 0.73 | ERCC1 (0.68) | RAB9APOLBNPC1MAOBALDH1A1 | |
| SCHEMBL4459444 | 0.71 | CTSB (0.47) | POLBALDH1A1LMNACYP3A4CYP2C9 | |
| SCHEMBL13671108 | 0.70 | CYP3A4 (0.60) | RAB9APOLBNPC1CYP3A4CYP2C9 | |
| SCHEMBL15678805 | 0.70 | CNR1 (0.55) | CASRRAB9APOLBALDH1A1LMNA | |
| SCHEMBL7392570 | 0.70 | CTSS (0.57) | — | |
| SCHEMBL2863230 | 0.69 | HDAC4 (0.61) | RAB9APOLBNPC1MAOBALDH1A1 | |
| SCHEMBL29521788 | 0.69 | ALDH1A1 (0.56) | RAB9APOLBNPC1MAOBALDH1A1 | |
| SCHEMBL10693686 | 0.69 | ALDH1A1 (0.56) | RAB9APOLBNPC1MAOBALDH1A1 | |
| SCHEMBL4456920 | 0.69 | P2RX7 (0.41) | POLBALDH1A1LMNA |
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-2009132452-A1 | DIARYL-CYCLYLALKYL DERIVATIVES AS CALCIUM CHANNEL BLOCKERS | NEUROMED PHARMACEUTICALS LTD. (CA) | 2009-11-05 | — | — | WO | disclosed |