Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 4/20 | 0.32 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7387448 | 0.82 | ACHE (0.40) | NAMPTALDH1A1TSHRHPGDCYP1A2 | |
| SCHEMBL15018821 | 0.81 | CHEK1 (0.35) | ALDH1A1TSHRSMN1; SMN2GAACHEK1 | |
| SCHEMBL25320420 | 0.80 | KMT2A (0.37) | ALDH1A1HPGD | |
| SCHEMBL25319984 | 0.80 | KMT2A (0.33) | ALDH1A1TSHRHPGDHDAC1KDM4E | |
| SCHEMBL25322244 | 0.78 | SMN1; SMN2 (0.41) | ALDH1A1TSHRHPGDKDM4ESMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL28408986 | 0.76 | KCNH2 (0.33) | ALDH1A1TSHRKDM4ESMN1; SMN2 | |
| SCHEMBL28305789 | 0.72 | TSHR (0.55) | ALDH1A1TSHRHPGDKDM4EGAA | |
| SCHEMBL28392673 | 0.71 | KMT2A (0.35) | ALDH1A1HPGDHDAC3HDAC1 | |
| SCHEMBL28534892 | 0.71 | IDO1 (0.31) | — | |
| SCHEMBL434055 | 0.70 | TSHR (0.43) | NAMPTALDH1A1TSHRHPGDGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-4215525-A1 | PIPERAZINE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF | Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) | 2023-07-26 | — | — | EP | disclosed |
| CN-116348109-A | Piperazine derivative, and preparation method and application thereof | 浙江海正药业股份有限公司 | 2023-06-27 | — | — | CN | disclosed |