Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7490885 | 0.82 | ALDH1A1 (0.51) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL3593284 | 0.80 | KCNN4 (0.53) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL7769347 | 0.80 | ALDH1A1 (1.00) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL8358191 | 0.80 | ALDH1A1 (0.67) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL6944126 | 0.80 | ALDH1A1 (0.67) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL7385780 | 0.80 | ALDH1A1 (0.67) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL5325708 | 0.80 | ALDH1A1 (0.67) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL29220422 | 0.79 | ALDH1A1 (0.51) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL1908316 | 0.78 | ALDH1A1 (0.65) | ALDH1A1TSHRHTTKMT2ASMN1; SMN2 | |
| SCHEMBL3613086 | 0.78 | ALDH1A1 (0.65) | ALDH1A1TSHRHTTKMT2ASMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0781778-B1 | Paclitaxel prodrugs, method for preparation as well as their use in selective chemotherapy | PHARMACHEMIE BV (NL) | 2002-04-17 | — | — | EP | disclosed |
| US-5760072-A | ANTITUMOR AGENTS | PHARMACHEMIE B.V. (NL) | 1998-06-02 | — | — | US | disclosed |
| EP-0781778-A1 | Novel paclitaxel prodrugs, method for preparation as well as their use in selective chemotherapy | PHARMACHEMIE B.V. (NL) | 1997-07-02 | — | — | EP | disclosed |