Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 2/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.45 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | BCR | P11274 | 1/20 | 0.45 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.44 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.44 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.44 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.44 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.44 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28792743 | 0.97 | PIN1 (0.46) | BACE1ABL1ABCB1BCRPIN1 | |
| SCHEMBL5510993 | 0.85 | MEN1 (0.48) | SMN1; SMN2CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL4961133 | 0.81 | PTPN1 (0.50) | BACE1PIN1SMN1; SMN2CYP1A1CYP1A2 | |
| SCHEMBL27821291 | 0.81 | BAZ2B (0.53) | BACE1PIN1CYP11B1CYP11B2SMN1; SMN2 | |
| SCHEMBL28792711 | 0.81 | MEN1 (0.42) | BACE1SMN1; SMN2CYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL7832063 | 0.80 | MEN1 (0.47) | CYP11B1CYP11B2SMN1; SMN2CYP1A2CYP3A4 | |
| SCHEMBL28792762 | 0.80 | ABL1 (0.55) | BACE1ABL1ABCB1BCRSMN1; SMN2 | |
| SCHEMBL31708810 | 0.76 | PTPN1 (0.46) | BACE1PIN1SMN1; SMN2CYP1A1CYP1A2 | |
| SCHEMBL9890648 | 0.76 | HSD17B10 (0.62) | BACE1ABL1SMN1; SMN2KDM4EMTNR1A | |
| SCHEMBL22264586 | 0.76 | BACE1 (0.67) | BACE1ABL1ABCB1BCRSMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101563322-A | 1H-indole-2-carboxylic acid derivatives useful as PPAR modulators | SMITHKLINE BEECHAM CORPORAITON (US) | 2009-10-21 | — | — | CN | disclosed |