Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | METAP2 | P50579 | 2/20 | 0.41 |
| ▸ | METAP1 | P53582 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.39 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | NEK2 | P51955 | 1/20 | 0.39 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA9 | Q16790 | 2/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA6 | P23280 | 1/20 | 0.38 |
| ▸ | CA5A | P35218 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6335916 | 0.84 | CYP2D6 (0.44) | CYP2D6METAP2METAP1KDM4EGAA | |
| SCHEMBL5699450 | 0.83 | IDO1 (0.46) | CYP2D6METAP2METAP1CHEK1CDK8 | |
| SCHEMBL5415754 | 0.83 | METAP2 (0.44) | CYP2D6METAP2METAP1KDM4ECHEK1 | |
| SCHEMBL7535551 | 0.82 | CA1 (0.46) | CYP2D6KDM4EGAAKEAP1CA2 | |
| SCHEMBL7542766 | 0.82 | CA12 (0.43) | CYP2D6KDM4EGAACA2CA1 | |
| SCHEMBL4271677 | 0.81 | CYP2D6 (0.49) | CYP2D6KDM4EGAAKEAP1CA2 | |
| SCHEMBL9338070 | 0.80 | CYP2D6 (0.48) | CYP2D6METAP2METAP1KDM4EGAA | |
| SCHEMBL28753723 | 0.80 | KEAP1 (0.47) | CYP2D6KDM4EGAAKEAP1CA2 | |
| SCHEMBL483213 | 0.80 | ALDH1A1 (0.51) | CYP2D6METAP2METAP1KDM4EGAA | |
| SCHEMBL29483445 | 0.80 | ALDH1A1 (0.51) | CYP2D6METAP2METAP1KDM4EGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4273856-A | — | — | None | — | — | JP | disclosed |
| JP-H04273856-A | PRODUCTION OF INDOLENINE COMPOUND | TAOKA CHEM CO LTD | 1992-09-30 | — | — | JP | disclosed |