Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.44 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA9 | Q16790 | 2/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NAAA | Q02083 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.39 |
| ▸ | MMP9 | P14780 | 2/20 | 0.38 |
| ▸ | MMP12 | P39900 | 2/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | FABP7 | O15540 | 1/20 | 0.37 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL774622 | 1.00 | EPHX1 (0.50) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL8726343 | 1.00 | EPHX1 (0.50) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL6477754 | 0.97 | EPHX1 (0.46) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL11589654 | 0.89 | EPHX1 (0.60) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL984315 | 0.89 | EPHX1 (0.60) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL8991654 | 0.89 | EPHX1 (0.60) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL13387598 | 0.89 | EPHX1 (0.60) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL8426647 | 0.89 | EPHX1 (0.60) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL37472 | 0.89 | EPHX1 (0.60) | EPHX1CA12CA1CA2CA9 | |
| SCHEMBL774623 | 0.88 | EPHX1 (0.45) | EPHX1CA12CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-6890377-B2 | Thermochromic rylene dyes | BASF AKTIENGESELLSCHAFT (DE) | 2005-05-10 | — | — | US | disclosed |
| US-20040089199-A1 | Thermochromic rylene dyes | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-13 | — | — | US | disclosed |
| US-6486319-B1 | Thermochromic rylene dyes | BASF AKTIENGESELLSCHAFT (DE) | 2002-11-26 | — | — | US | disclosed |