Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | MMP8 | P22894 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 1/20 | 0.38 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | PPARA | Q07869 | 2/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16865453 | 0.74 | ALDH1A1 (0.57) | PIN1CYP3A4CYP2D6ALDH1A1RECQL | |
| SCHEMBL644718 | 0.73 | RIPK1 (0.44) | PIN1CYP2D6TDP1ALDH1A1POLB | |
| SCHEMBL27313970 | 0.71 | PIN1 (0.49) | PIN1CYP3A4TDP1ALDH1A1RECQL | |
| SCHEMBL27585378 | 0.70 | CYP3A4 (0.63) | PIN1CYP3A4CYP2D6ALDH1A1RECQL | |
| SCHEMBL1960388 | 0.69 | ELANE (0.49) | TDP1ALDH1A1LMNAPOLBNPC1 | |
| SCHEMBL1964634 | 0.69 | TDP1 (0.50) | PIN1CYP3A4TDP1ALDH1A1RECQL | |
| SCHEMBL8483586 | 0.68 | PIN1 (0.53) | PIN1CYP3A4CYP2D6ALDH1A1RECQL | |
| SCHEMBL28230446 | 0.68 | PIN1 (0.49) | PIN1CYP3A4TDP1ALDH1A1RECQL | |
| SCHEMBL11358611 | 0.68 | OPRK1 (0.63) | PIN1CYP3A4TDP1ALDH1A1RECQL | |
| SCHEMBL28069454 | 0.68 | PIN1 (0.49) | PIN1CYP2D6TDP1ALDH1A1RECQL |
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 |
|---|---|---|---|---|---|---|---|
| CN-1028100-C | Process for preparing phenoxy-heterocyclic compounds | MIDICINE INST CHINESE MEDICAL (CN) | 1995-04-05 | — | — | CN | disclosed |
| CN-1051039-A | Phenoxy group-heterogeneous ring compound | MERRELL DOW PHARMA (US) | 1991-05-01 | — | — | CN | disclosed |