Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH5A1 | P51649 | 2/20 | 0.42 |
| ▸ | ABAT | P80404 | 2/20 | 0.42 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.35 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.35 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.35 |
| ▸ | NQO2 | P16083 | 2/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA3 | P07451 | 2/20 | 0.33 |
| ▸ | CA4 | P22748 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4575600 | 0.82 | ALDH5A1 (0.52) | ALDH5A1ABATLCKKDM4EPTGS2 | |
| SCHEMBL37131 | 0.82 | LCK (0.58) | ALDH5A1ABATLCKKDM4EPTGS2 | |
| SCHEMBL13861822 | 0.82 | ALDH1A1 (0.36) | ALDH5A1ABATKDM4EPTGS2RAB9A | |
| SCHEMBL9261197 | 0.82 | LCK (0.58) | ALDH5A1ABATLCKKDM4EPTGS2 | |
| SCHEMBL15715521 | 0.82 | ALDH1A1 (0.36) | ALDH5A1ABATKDM4EPTGS2RAB9A | |
| Potassium SCHEMBL31540630 | 0.79 | LCK (0.55) | ALDH5A1ABATLCKKDM4EPTGS2 | |
| Phloroglucinol SCHEMBL28580013 | 0.76 | ALDH5A1 (0.52) | ALDH5A1ABATLCKKDM4EPTGS2 | |
| SCHEMBL10267731 | 0.73 | — | — | |
| SCHEMBL19186984 | 0.73 | — | — | |
| SCHEMBL12527375 | 0.71 | HSD17B10 (0.42) | ALDH1A1TDP1HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-7202265-B2 | Indolinone combinatorial libraries and related products and methods for the treatment of disease | SUGEN, INC. (US) | 2007-04-10 | — | — | US | disclosed |