Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.40 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.40 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28788157 | 1.00 | CYP19A1 (0.46) | CYP19A1PKMPOLBALDH1A1KMT2A | |
| SCHEMBL6597520 | 0.82 | CYP19A1 (0.51) | CYP19A1PKMPOLBALDH1A1KMT2A | |
| SCHEMBL5828718 | 0.82 | CYP19A1 (0.54) | CYP19A1PKMPOLBALDH1A1KMT2A | |
| SCHEMBL8116597 | 0.81 | CYP19A1 (0.50) | CYP19A1POLBALDH1A1HRH4MAPT | |
| SCHEMBL27532988 | 0.77 | CYP19A1 (0.55) | CYP19A1POLBALDH1A1HRH4MAPT | |
| SCHEMBL23320461 | 0.76 | CYP19A1 (0.54) | CYP19A1POLBALDH1A1HRH4MAPT | |
| SCHEMBL6257538 | 0.76 | CYP19A1 (0.54) | CYP19A1PKMPOLBALDH1A1KMT2A | |
| SCHEMBL28788142 | 0.75 | KDM4E (0.52) | CYP19A1POLBALDH1A1HRH4MAPT | |
| SCHEMBL28007741 | 0.75 | CYP19A1 (0.54) | CYP19A1PKMPOLBALDH1A1KMT2A | |
| SCHEMBL27602612 | 0.74 | CYP19A1 (0.52) | CYP19A1PKMPOLBALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-116675704-A | Pyrrole derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2023-09-01 | — | — | CN | disclosed |
| CN-114644634-B | Pyrrole derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2023-06-20 | — | — | CN | disclosed |
| WO-2022134837-A1 | PYRROLE DERIVATIVE, AND PREPARATION METHOD AND USE THEREFOR | 深圳市祥根生物医药有限公司 | 2022-06-30 | — | — | WO | disclosed |
| CN-114644634-A | Pyrrole derivative and preparation method and application thereof | 深圳市祥根生物医药有限公司 | 2022-06-21 | — | — | CN | disclosed |