Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.33 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.33 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | EDNRA | P25101 | 1/20 | 0.33 |
| ▸ | HTRA1 | Q92743 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8394419 | 0.81 | KMT2A (0.36) | SMN1; SMN2TAS1R3TAS1R1TAS1R2TDP1 | |
| SCHEMBL7343203 | 0.79 | CYP1A2 (0.48) | MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL7337135 | 0.72 | ALDH1A1 (0.36) | KDM1ASMN1; SMN2ALDH1A1EDNRAMAPT | |
| SCHEMBL8397312 | 0.69 | CYP2D6 (0.42) | MAPT | |
| SCHEMBL8399100 | 0.67 | ADORA3 (0.35) | SMN1; SMN2TDP1ALDH1A1MAPTCYP2C9 | |
| SCHEMBL10052320 | 0.65 | CYP2D6 (0.40) | SMN1; SMN2TAS1R3TAS1R1TAS1R2ALDH1A1 | |
| SCHEMBL20055159 | 0.64 | CYP2D6 (0.41) | SMN1; SMN2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL20622277 | 0.64 | CYP2D6 (0.41) | SMN1; SMN2TAS1R3TAS1R1TAS1R2 | |
| SCHEMBL14853205 | 0.62 | HDAC1 (0.57) | ALDH1A1POLBMAPTCYP2C9TSHR | |
| SCHEMBL31159159 | 0.62 | NPC1 (0.53) | ALDH1A1MAPTCYP2C9 |
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-0590650-B1 | Cyclopropene derivatives with thiol protease inhibiting activity | MITSUBISHI CHEM CORP (JP) | 1999-05-26 | — | — | EP | disclosed |
| US-5395958-A | Intermediates for enzyme inhibitors | MITSUBISHI KASEI CORPORATION (JP) | 1995-03-07 | — | — | US | disclosed |
| EP-0590650-A1 | Cyclopropene derivatives with thiol protease inhibiting activity | Mitsubishi Chemical Corporation (JP) | 1994-04-06 | — | — | EP | disclosed |