Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 6/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | MAOB | P27338 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 7/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 7/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 5/20 | 0.42 |
| ▸ | BCL2 | P10415 | 4/20 | 0.42 |
| ▸ | PABPC1 | P11940 | 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 | |
|---|---|---|---|---|
| SCHEMBL459050 | 0.75 | KMT2A (0.44) | MAOAMAPTALDH1A1MAPK1ALOX15 | |
| SCHEMBL29641696 | 0.75 | KMT2A (0.44) | MAOAMAPTALDH1A1MAPK1ALOX15 | |
| SCHEMBL7793655 | 0.72 | MAPT (0.51) | MAOAMAPTALDH1A1MAPK1HPGD | |
| SCHEMBL2076402 | 0.72 | MAPT (0.75) | MAOAMAPTALDH1A1MAPK1HPGD | |
| SCHEMBL30420953 | 0.72 | MAPT (0.75) | MAOAMAPTALDH1A1MAPK1HPGD | |
| SCHEMBL1103721 | 0.71 | MEN1 (0.44) | MAOAMAPTALDH1A1ALOX15SMN1; SMN2 | |
| SCHEMBL29860296 | 0.71 | TOP1 (0.46) | MAOAMAPTSMN1; SMN2MAOBHSP90AA1 | |
| Anthrarufin SCHEMBL25355428 | 0.68 | MAOA (0.86) | MAOAMAPTALDH1A1MAPK1HPGD | |
| 1-Hydroxyanthraquinone SCHEMBL145303 | 0.68 | MAOA (0.86) | MAOAMAPTALDH1A1MAPK1HPGD | |
| 1-Hydroxyanthraquinone SCHEMBL30912125 | 0.68 | MAOA (0.86) | MAOAMAPTALDH1A1MAPK1HPGD |
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-7927613-B2 | Pharmaceutical co-crystal compositions | UNIVERSITY OF SOUTH FLORIDA (US) | 2011-04-19 | — | — | US | disclosed |