Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8876050 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNAHPGDHDAC1SMN1; SMN2 | |
| SCHEMBL3782505 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNAHPGDHDAC1SMN1; SMN2 | |
| SCHEMBL9293035 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNAHPGDHDAC1SMN1; SMN2 | |
| SCHEMBL9581181 | 0.90 | ALDH1A1 (0.49) | ALDH1A1LMNAHPGDHDAC1SMN1; SMN2 | |
| SCHEMBL9293004 | 0.82 | CTSK (0.45) | — | |
| SCHEMBL7218496 | 0.82 | CTSK (0.45) | — | |
| SCHEMBL9293123 | 0.82 | ALDH1A1 (0.48) | ALDH1A1LMNAHPGDHDAC1SMN1; SMN2 | |
| SCHEMBL8529886 | 0.82 | CTSK (0.45) | — | |
| SCHEMBL3782920 | 0.82 | CTSK (0.45) | — | |
| SCHEMBL9214743 | 0.80 | ALDH1A1 (0.57) | ALDH1A1LMNAHPGDHDAC1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0639186-B1 | TAXOL DERIVATIVES | ABBOTT LAB (US) | 1999-06-23 | — | — | EP | disclosed |
| US-5594157-A | Process for making taxol derivatives | ABBOTT LABORATORIES (US) | 1997-01-14 | — | — | US | disclosed |
| US-5530020-A | PLANT EXTRACT; ANTICARCINOGENIC AGENT | ABBOTT LABORATORIES (US) | 1996-06-25 | — | — | US | disclosed |
| US-5352806-A | Anticarcinogenic agents | ABBOTT LABORATORIES (US) | 1994-10-04 | — | — | US | disclosed |
| WO-1993021173-A1 | TAXOL DERIVATIVES | ABBOTT LABORATORIES (US) | 1993-10-28 | — | — | WO | disclosed |