Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.43 |
| ▸ | PGR | P06401 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.41 |
| ▸ | TUBB | P07437 | 1/20 | 0.41 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.41 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.41 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.41 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.41 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12945429 | 0.84 | SLC40A1 (0.46) | ALDH1A1LMNACA1CA2ALOX12 | |
| SCHEMBL12945230 | 0.84 | KEAP1 (0.60) | ALDH1A1LMNAFFAR4PGRTP53 | |
| SCHEMBL12945432 | 0.82 | CA1 (0.40) | ALDH1A1CA1CA2PGRGAA | |
| SCHEMBL12945621 | 0.76 | KEAP1 (0.61) | FFAR4PGRKEAP1GAANFE2L2 | |
| SCHEMBL8420054 | 0.75 | KEAP1 (0.46) | ALDH1A1PGRKEAP1GAAKMT2A | |
| SCHEMBL31011735 | 0.73 | MAPT (0.49) | ALDH1A1ALOX12TP53CYP3A4ALOX15 | |
| SCHEMBL5130307 | 0.72 | GABRA1 (0.41) | ALDH1A1LMNAALOX12TSHRSMN1; SMN2 | |
| SCHEMBL12945430 | 0.71 | CA2 (0.53) | ALDH1A1LMNACA1CA2SMN1; SMN2 | |
| SCHEMBL28655832 | 0.70 | KEAP1 (0.50) | ALDH1A1TSHRSMN1; SMN2KEAP1KMT2A | |
| SCHEMBL9179590 | 0.69 | TGM2 (0.59) | ALDH1A1LMNACA1CA2PGR |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011009059-A2 | METHOD OF TREATING OR PREVENTING CANCER | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-01-20 | — | — | WO | disclosed |