Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CCR1 | P32246 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
| ▸ | METAP1 | P53582 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.39 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8759441 | 0.75 | ALDH1A1 (0.40) | CYP2D6CYP2C19KDM4ELMNACYP1A2 | |
| SCHEMBL30749067 | 0.74 | CYP2D6 (0.44) | CYP2D6CYP2C19KDM4ELMNACYP1A2 | |
| Bromide SCHEMBL9368680 | 0.72 | CYP2D6 (0.47) | CYP2D6CYP2C19KDM4ELMNACYP1A2 | |
| SCHEMBL2289138 | 0.72 | CYP2D6 (0.50) | CYP2D6CYP2C19KDM4ELMNACYP1A2 | |
| SCHEMBL5534845 | 0.72 | HDAC8 (0.32) | KDM4ELMNAALDH1A1HDAC8SMN1; SMN2 | |
| Water SCHEMBL28870924 | 0.71 | CYP2D6 (0.55) | CYP2D6CYP2C19KDM4ELMNACYP1A2 | |
| SCHEMBL9343532 | 0.71 | ALDH1A1 (0.50) | CYP2D6CYP2C19KDM4ELMNACYP1A2 | |
| SCHEMBL504447 | 0.71 | LMNA (0.36) | CYP2D6CYP2C19LMNAPOLBKMT2A | |
| SCHEMBL11088915 | 0.71 | ALDH1A1 (0.43) | CYP2D6CYP2C19KDM4ELMNAPOLB | |
| SCHEMBL8202219 | 0.70 | CYP2D6 (0.48) | CYP2D6CYP2C19KDM4ELMNACYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-2000212462-A | TITANYLTETRAAZAPORPHYRIN DERIVATIVE MIXTURE AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR MADE BY USING IT | RICOH CO LTD | 2000-08-02 | — | — | JP | disclosed |