Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TGM2 | P21980 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9818046 | 0.72 | ALDH1A1 (0.36) | CYP2C19ALDH1A1TSHRAKT1HTT | |
| SCHEMBL5729478 | 0.72 | ALDH1A1 (0.36) | CYP2C19ALDH1A1TSHRAKT1HTT | |
| SCHEMBL11600767 | 0.71 | CYP1A2 (0.43) | ALDH1A1TSHRSMN1; SMN2MEN1KMT2A | |
| SCHEMBL7403368 | 0.71 | ALDH1A1 (0.34) | CYP2C19ALDH1A1TSHRAKT1HTT | |
| SCHEMBL2363937 | 0.70 | ALDH1A1 (0.35) | CYP2C19ALDH1A1TSHRLMNA | |
| SCHEMBL11649367 | 0.69 | TSHR (0.34) | CYP2C19ALDH1A1TSHRAKT1HTT | |
| SCHEMBL10425005 | 0.69 | ALDH1A1 (0.41) | CYP2C19ALDH1A1TSHRCYP3A4LMNA | |
| SCHEMBL11649668 | 0.68 | ALDH1A1 (0.33) | CYP2C19ALDH1A1TSHRLMNA | |
| SCHEMBL4045851 | 0.68 | ALDH1A1 (0.33) | CYP2C19ALDH1A1TSHRLMNACYP1A2 | |
| SCHEMBL11652322 | 0.68 | ALDH1A1 (0.33) | CYP2C19ALDH1A1TSHRLMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| US-4115378-A | TEXTILES | BAYER AKTIENGESELLSCHAFT (DE) | 1978-09-19 | — | — | US | claimed |