Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 12/20 | 0.57 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | GALR3 | O60755 | 1/20 | 0.47 |
| ▸ | NR2F2 | P24468 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | CLK1 | P49759 | 2/20 | 0.45 |
| ▸ | PDE2A | O00408 | 1/20 | 0.45 |
| ▸ | PDE1A | P54750 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5129003 | 0.85 | BCDIN3D (0.46) | PDE5AMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL7617647 | 0.80 | PDE5A (0.52) | PDE5AMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5117565 | 0.79 | PRKCI (0.48) | PDE5AMEN1KMT2AALDH1A1CLK4 | |
| SCHEMBL5129787 | 0.79 | METAP1 (0.47) | PDE5AKMT2AALDH1A1SMN1; SMN2NPC1 | |
| SCHEMBL5122859 | 0.79 | BCDIN3D (0.43) | PDE5AMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5122882 | 0.78 | BCDIN3D (0.41) | PDE5AMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5128694 | 0.78 | BCDIN3D (0.40) | PDE5AMEN1KMT2AMAPT | |
| SCHEMBL16997374 | 0.77 | PDE5A (0.78) | PDE5AMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL16997381 | 0.77 | PDE5A (0.59) | PDE5AMEN1KMT2AALDH1A1SMN1; SMN2 | |
| SCHEMBL5780434 | 0.77 | PDE5A (0.41) | PDE5AMEN1KMT2AALDH1A1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6432950-B1 | ANTICANCER AGENTS; KILLING CANCER CELLS | CELL PATHWAYS | 2002-08-13 | — | — | US | disclosed |
| US-6133271-A | Method for inhibiting neoplastic cells and related conditions by exposure thienopyrimidine derivatives | CELL PATHWAYS, INC. (US) | 2000-10-17 | — | — | US | disclosed |