Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | ERN1 | O75460 | 2/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | GLS | O94925 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30045799 | 0.90 | CYP19A1 (0.48) | CYP19A1TBXAS1KDM4EMAPTPOLB | |
| SCHEMBL2319949 | 0.88 | LOXL2 (0.55) | CYP19A1TBXAS1KDM4EMAPTLMNA | |
| SCHEMBL29954736 | 0.82 | MAPT (0.48) | CYP19A1TBXAS1KDM4EMAPTPOLB | |
| SCHEMBL6878679 | 0.82 | MAPT (0.48) | CYP19A1TBXAS1KDM4EMAPTPOLB | |
| SCHEMBL5500729 | 0.80 | CYP19A1 (0.54) | CYP19A1TBXAS1KDM4EMAPTPOLB | |
| SCHEMBL6970292 | 0.80 | CYP19A1 (0.54) | CYP19A1TBXAS1KDM4EMAPTPOLB | |
| SCHEMBL27586032 | 0.79 | CYP19A1 (0.47) | CYP19A1TBXAS1KDM4EMAPTPOLB | |
| SCHEMBL5191653 | 0.78 | LOXL2 (0.51) | KDM4EMAPTLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL5205163 | 0.77 | LOXL2 (0.50) | KDM4EMAPTLMNAALDH1A1SMN1; SMN2 | |
| SCHEMBL6114797 | 0.77 | CYP19A1 (0.54) | CYP19A1TBXAS1KDM4EMAPTPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021138298-A1 | MALT1 MODULATORS AND USES THEREOF | RHEOS MEDICINES, INC. (US) | 2021-07-08 | — | — | WO | disclosed |
| US-5776939-A | PIPERAZINE DERIVATIVES | ELI LILLY AND COMPANY (US) | 1998-07-07 | — | — | US | disclosed |
| WO-1998022112-A1 | DRUG RESISTANCE AND MULTIDRUG RESISTANCE MODULATORS | ELI LILLY AND COMPANY (US) | 1998-05-28 | — | — | WO | disclosed |
| EP-0844244-A1 | Drug resistance and multidrug resistance modulators | ELI LILLY AND COMPANY (US) | 1998-05-27 | — | — | EP | disclosed |