Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4724773 | 0.74 | LMNA (0.35) | SMN1; SMN2P2RX4BCHE | |
| SCHEMBL27685582 | 0.72 | P2RX4 (0.36) | P2RX4BCHE | |
| SCHEMBL27868729 | 0.72 | — | — | |
| SCHEMBL27860620 | 0.71 | PKM (0.35) | PKMSMN1; SMN2P2RX4BCHECYP1A2 | |
| SCHEMBL29855614 | 0.71 | TSHR (0.33) | CYP2D6CYP3A4 | |
| SCHEMBL4788208 | 0.71 | — | — | |
| SCHEMBL4722936 | 0.71 | — | — | |
| SCHEMBL3588715 | 0.71 | MAPK1 (0.35) | SMN1; SMN2CYP3A4 | |
| SCHEMBL8865924 | 0.71 | — | — | |
| SCHEMBL6034344 | 0.70 | ALDH1A1 (0.33) | SMN1; SMN2P2RX4BCHE |
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 |
|---|---|---|---|---|---|---|---|
| EP-0832887-B1 | N-acylpiperazine derivative, anti-ulcer drug, and antibacterial drug | SHISEIDO CO LTD (JP) | 2001-08-08 | — | — | EP | disclosed |
| US-5962456-A | PEPTIC ULCERS | SHISEIDO CO., LTD. (JP) | 1999-10-05 | — | — | US | disclosed |
| EP-0832887-A1 | N-acylpiperazine derivative, anti-ulcer drug, and antibacterial drug | SHISEIDO COMPANY LIMITED (JP) | 1998-04-01 | — | — | EP | disclosed |