Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.46 |
| ▸ | MMP9 | P14780 | 1/20 | 0.46 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28707626 | 0.83 | MMP2 (0.48) | KDM4EALDH1A1HPGDHSD17B10MMP2 | |
| SCHEMBL28707627 | 0.82 | ALDH1A1 (0.46) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9828121 | 0.81 | MEN1 (0.47) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL28479085 | 0.81 | PARP1 (0.53) | KDM4EALDH1A1HPGDHSD17B10MMP2 | |
| SCHEMBL29405049 | 0.80 | MMP2 (0.46) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL19765218 | 0.79 | KDM4E (0.48) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL31538460 | 0.79 | KMT2A (0.48) | ALDH1A1HDAC6SMN1; SMN2EGLN1 | |
| SCHEMBL27696507 | 0.77 | MMP2 (0.44) | KDM4EALDH1A1HPGDHSD17B10MMP2 | |
| SCHEMBL3711541 | 0.77 | KDM4E (0.59) | POLBKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30553881 | 0.77 | KDM4E (0.59) | POLBKDM4EALDH1A1HPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5436240-A | Schizophrenia, Parkinson's disease, depression or hypotensive agents using tricyclic amines | THE UPJOHN COMPANY (US) | 1995-07-25 | — | — | US | disclosed |
| EP-0480939-A1 | HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY. | UPJOHN CO (US) | 1992-04-22 | — | — | EP | disclosed |
| WO-1990015058-A1 | HETEROCYCLIC AMINES HAVING CENTRAL NERVOUS SYSTEM ACTIVITY | THE UPJOHN COMPANY (US) | 1990-12-13 | — | — | WO | disclosed |