Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 7/20 | 0.51 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.51 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.50 |
| ▸ | MAOA | P21397 | 3/20 | 0.49 |
| ▸ | HCAR2 | Q8TDS4 | 2/20 | 0.47 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | ESR1 | P03372 | 1/20 | 0.47 |
| ▸ | CA3 | P07451 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 1/20 | 0.47 |
| ▸ | CA6 | P23280 | 1/20 | 0.47 |
| ▸ | DPP4 | P27487 | 1/20 | 0.47 |
| ▸ | CA5A | P35218 | 1/20 | 0.47 |
| ▸ | CA7 | P43166 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5694639 | 1.00 | CYP1A2 (0.51) | CYP1A2MAOBCYP1B1CXCL12MAOA | |
| SCHEMBL4407258 | 0.87 | HDAC3 (0.58) | MAOBCYP1B1HCAR2CA12AKR1B10 | |
| SCHEMBL4407256 | 0.87 | HDAC3 (0.58) | MAOBCYP1B1HCAR2CA12AKR1B10 | |
| SCHEMBL5694796 | 0.84 | MAPT (0.56) | MAOBCYP1B1MAOAHCAR2CA12 | |
| SCHEMBL5694646 | 0.84 | TNFRSF1A (0.56) | MAOBCYP1B1MAOAHCAR2CA12 | |
| SCHEMBL5694798 | 0.84 | MAPT (0.56) | MAOBCYP1B1MAOAHCAR2CA12 | |
| SCHEMBL5694645 | 0.84 | TNFRSF1A (0.56) | MAOBCYP1B1MAOAHCAR2CA12 | |
| SCHEMBL5694655 | 0.83 | HDAC2 (0.53) | CYP1A2CYP1B1HCAR2CA12AKR1B10 | |
| SCHEMBL5694657 | 0.83 | HDAC2 (0.53) | CYP1A2CYP1B1HCAR2CA12AKR1B10 | |
| SCHEMBL126171 | 0.83 | CYP1A2 (0.72) | CYP1A2MAOBCYP1B1CXCL12MAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1094055-B1 | NOVEL VINYLBENZENE DERIVATIVES | SANTEN PHARMACEUTICAL CO LTD (JP) | 2006-04-26 | — | — | EP | disclosed |
| US-6329547-B1 | USEFUL AS THERAPEUTIC AGENTS FOR GLAUCOMA | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2001-12-11 | — | — | US | disclosed |
| EP-1094055-A1 | NOVEL VINYLBENZENE DERIVATIVES | SANTEN PHARMACEUTICAL CO., LTD. (JP) | 2001-04-25 | — | — | EP | disclosed |