Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | NPC1 | O15118 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PDE1A | P54750 | 4/20 | 0.37 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.37 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11183610 | 0.90 | CYP3A4 (0.41) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| SCHEMBL11186215 | 0.85 | CHRM2 (0.39) | CYP3A4TSHRNR1I2LMNACYP1A2 | |
| SCHEMBL11178895 | 0.79 | PDE5A (0.41) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| Hydrochloric Acid SCHEMBL11190666 | 0.78 | PDE5A (0.40) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| SCHEMBL11174540 | 0.78 | TP53 (0.39) | CYP3A4TSHRNR1I2LMNACYP1A2 | |
| SCHEMBL11182845 | 0.77 | PDE5A (0.39) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| SCHEMBL11181997 | 0.77 | NPC1 (0.41) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| SCHEMBL11177813 | 0.76 | CYP3A4 (0.39) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| SCHEMBL11185831 | 0.76 | PDE5A (0.38) | PDE5ACYP3A4TSHRNR1I2LMNA | |
| Hydrochloric Acid SCHEMBL11182705 | 0.75 | CYP3A4 (0.38) | PDE5ACYP3A4TSHRNR1I2LMNA |
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-4367230-A | ANTIANOXIC AGENTS | TANABE SEIYAKU CO., LTD. (JP) | 1983-01-04 | — | — | US | claimed |
| US-4367230-A | ANTIANOXIC AGENTS | TANABE SEIYAKU CO., LTD. (JP) | 1983-01-04 | — | — | US | disclosed |