Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL9718405 | 0.88 | PKM (0.57) | PKMCYP2D6CYP2C9CYP2C19TSHR | |
| SCHEMBL9718391 | 0.88 | TSHR (0.63) | PKMCYP2D6CYP2C9CYP2C19TSHR | |
| SCHEMBL7217749 | 0.78 | CYP2D6 (0.72) | PKMCYP2D6CYP2C9CYP2C19TSHR | |
| SCHEMBL5652601 | 0.76 | CYP2D6 (0.79) | PKMCYP2D6CYP2C9CYP2C19TSHR | |
| SCHEMBL10697737 | 0.76 | TBXA2R (0.63) | MEN1KMT2ALMNAMAPTALDH1A1 | |
| SCHEMBL10699471 | 0.76 | CYP1A2 (0.62) | CYP2D6CYP2C19TSHRPOLBMEN1 | |
| SCHEMBL15828898 | 0.75 | PKM (1.00) | PKMCYP2D6CYP2C9CYP2C19POLB | |
| SCHEMBL1164461 | 0.73 | CYP2D6 (0.74) | PKMCYP2D6CYP2C9CYP2C19TSHR | |
| SCHEMBL23052533 | 0.72 | CYP2D6 (0.72) | PKMCYP2D6CYP2C9CYP2C19TSHR | |
| SCHEMBL7193591 | 0.71 | CYP2D6 (0.70) | PKMCYP2D6CYP2C9CYP2C19TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0260527-A2 | Synergetic combination comprising a phosphodiesterase inhibitor and a thromboxan-A2-antagonist, and their use or manufacture | Dr. Karl Thomae GmbH (DE) | 1988-03-23 | — | — | EP | disclosed |