Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 6/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7305966 | 0.82 | PDE3B (0.57) | ALDH1A1HPGDKDM4EMEN1KMT2A | |
| SCHEMBL7313861 | 0.71 | PDE3B (0.44) | ALDH1A1HPGDKDM4EMEN1KMT2A | |
| SCHEMBL7317446 | 0.70 | TP53 (0.44) | ALDH1A1HPGDKDM4ELMNAPDE3B | |
| SCHEMBL7315407 | 0.70 | PDE3B (0.46) | ALDH1A1KDM4EATMMEN1KMT2A | |
| SCHEMBL7307946 | 0.69 | PDE3B (0.54) | KDM4EPDE3BPDE3ATSHR | |
| SCHEMBL7316886 | 0.69 | HSD17B10 (0.40) | ALDH1A1RAB9AHPGDKDM4EMEN1 | |
| SCHEMBL7309250 | 0.69 | PDE3B (0.44) | ALDH1A1HPGDKDM4EMEN1KMT2A | |
| SCHEMBL2601402 | 0.68 | SMN1; SMN2 (0.61) | MEN1KMT2ASMN1; SMN2HSD17B10 | |
| SCHEMBL673154 | 0.66 | HPGD (0.51) | ALDH1A1RAB9AHPGDKDM4EMEN1 | |
| Hydrochloric Acid SCHEMBL11971635 | 0.66 | PDE10A (0.66) | ALDH1A1RAB9AKDM4EMEN1KMT2A |
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-4822800-A | Isoquinolinol compounds having cardiotonic and phosphodiesterase fraction III inhibiting properties and/or renal vasodilating properties | ORTHO PHARMACEUTICAL CORPORATION (US) | 1989-04-18 | — | — | US | claimed |