Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 2/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP3 | P08254 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL12765276 | 0.81 | HPGD (0.58) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL12765275 | 0.79 | HPGD (0.56) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL10702291 | 0.79 | CYP2D6 (0.61) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL9464503 | 0.77 | CYP2D6 (0.59) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL15224105 | 0.77 | TDP1 (0.57) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL30852953 | 0.76 | HPGD (0.50) | EPHX1HPGDALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL22197123 | 0.76 | EPHX1 (0.59) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL17787740 | 0.76 | EPHX1 (0.59) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL2937238 | 0.76 | EPHX1 (0.59) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL15224107 | 0.76 | CYP2D6 (0.58) | EPHX1CYP2D6HPGDALDH1A1SMN1; SMN2 |
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-2007059116-A2 | GELDANAMYCIN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF | ABRAXIS BIOSCIENCE, INC. (US) | 2007-05-24 | — | — | WO | disclosed |