Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.34 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | XBP1 | P17861 | 1/20 | 0.31 |
| ▸ | CRHBP | P24387 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.31 |
| ▸ | MAT2A | P31153 | 1/20 | 0.31 |
| ▸ | DRD1 | P21728 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14620060 | 0.83 | CYP1B1 (0.34) | CYP1B1SIRT2SIRT1KDM4EALDH1A1 | |
| SCHEMBL14620260 | 0.79 | CYP1B1 (0.39) | CYP1B1SIRT2SIRT1KDM4EALDH1A1 | |
| SCHEMBL14620039 | 0.74 | — | — | |
| SCHEMBL14620046 | 0.71 | — | — | |
| SCHEMBL14620055 | 0.68 | ALDH1A1 (0.39) | KDM4EALDH1A1HPGDHSD17B10KMT2A | |
| SCHEMBL14620266 | 0.67 | ALDH1A1 (0.38) | ALDH1A1KMT2ACHRM1 | |
| SCHEMBL14620051 | 0.66 | EPHX1 (0.35) | ALDH1A1MEN1MAPK1KMT2A | |
| SCHEMBL14620052 | 0.66 | MAOA (0.40) | SIRT2SIRT1KDM4EALDH1A1POLB | |
| SCHEMBL14620057 | 0.65 | DRD1 (0.35) | KDM4EALDH1A1POLBHPGDHSD17B10 | |
| SCHEMBL14620183 | 0.65 | ALDH1A1 (0.33) | ALDH1A1CHRM1 |
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-2007003520-A1 | FLUORESCENT DIKETOPYRROLOPYRROLES AND DERIVATIVES | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2007-01-11 | — | — | WO | disclosed |