Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.53 |
| ▸ | CCR1 | P32246 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.46 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL6159618 | 0.91 | POLB (0.56) | POLBCCR1TSHRALDH1A1KDM1A | |
| SCHEMBL11226541 | 0.82 | POLB (0.58) | POLBCCR1TSHRALDH1A1HDAC3 | |
| SCHEMBL14050745 | 0.82 | CCR1 (0.68) | POLBCCR1TSHRALDH1A1CYP3A4 | |
| SCHEMBL6437249 | 0.80 | POLB (0.62) | POLBCCR1TSHRALDH1A1HDAC3 | |
| SCHEMBL11857079 | 0.78 | ALDH1A1 (0.46) | POLBCCR1ALDH1A1KDM1A | |
| SCHEMBL1163022 | 0.78 | MAPK1 (0.59) | CHEK1CDK2AP1PBKHDAC4 | |
| SCHEMBL1163023 | 0.78 | MAPK1 (0.59) | CHEK1CDK2AP1PBKHDAC4 | |
| SCHEMBL28280152 | 0.78 | MAPK1 (0.59) | CHEK1CDK2AP1PBKHDAC4 | |
| SCHEMBL12260725 | 0.75 | EPHX1 (0.68) | ALDH1A1CHEK1CDK2AP1CYP2C19 | |
| SCHEMBL10688696 | 0.74 | ALDH1A1 (0.68) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3148518-B1 | NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS | SPHAERA PHARMA PRIVATE LTD (IN) | 2022-11-30 | — | — | EP | disclosed |