Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.63 |
| ▸ | LMNA | P02545 | 3/20 | 0.63 |
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | HTR2A | P28223 | 2/20 | 0.52 |
| ▸ | HTR2C | P28335 | 2/20 | 0.52 |
| ▸ | HTR7 | P34969 | 1/20 | 0.51 |
| ▸ | HTR6 | P50406 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | UBE2N | P61088 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9444257 | 0.94 | KCNH2 (0.60) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| SCHEMBL9076460 | 0.89 | KCNH2 (0.58) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| SCHEMBL9077025 | 0.88 | KCNH2 (0.50) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| Hydrochloric Acid SCHEMBL9076457 | 0.88 | KCNH2 (0.59) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| SCHEMBL9079271 | 0.88 | KCNH2 (0.56) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| Hydrochloric Acid SCHEMBL9077228 | 0.88 | KCNH2 (0.56) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| Hydrochloric Acid SCHEMBL9077240 | 0.88 | KCNH2 (0.56) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| SCHEMBL9077704 | 0.87 | MEN1 (0.57) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| Hydrochloric Acid SCHEMBL9078685 | 0.87 | KCNH2 (0.51) | SMN1; SMN2LMNAHTTALDH1A1KCNH2 | |
| SCHEMBL9079238 | 0.87 | KCNH2 (0.60) | SMN1; SMN2LMNAHTTKCNH2CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5500433-A | PIPERIDINYL MEDICINAL AGENTS | MERRELL PHARMACEUTICALS INC. (US) | 1996-03-19 | — | — | US | disclosed |
| EP-0437790-B1 | Antithrombotic compounds | MERRELL DOW PHARMA (US) | 1996-01-17 | — | — | EP | disclosed |
| US-5292752-A | N-(p-fluorobenzoylmethyl)-4-(p-amidobenzoyl)piperidines | MERRELL DOW PHARMACEUTICALS INC. (US) | 1994-03-08 | — | — | US | disclosed |
| EP-0437790-A2 | Antithrombotic compounds | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-07-24 | — | — | EP | disclosed |