Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | GABRR1 | P24046 | 1/20 | 0.30 |
| ▸ | GABRR2 | P28476 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.30 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.30 |
| ▸ | PARP1 | P09874 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4536953 | 0.67 | AKR1B1 (0.34) | ALDH1A1HTTTSHR | |
| SCHEMBL6322288 | 0.66 | AKR1B1 (0.48) | HTTTSHR | |
| SCHEMBL14295056 | 0.63 | ALDH1A1 (0.37) | ALDH1A1HTTGABRR1 | |
| Trifluoroacetic Acid SCHEMBL3398634 | 0.62 | — | — | |
| SCHEMBL14300341 | 0.60 | ALDH1A1 (0.35) | ALDH1A1HTTGABRR1 | |
| Hydrochloric Acid SCHEMBL15092651 | 0.60 | KMT2A (0.35) | KMT2A | |
| SCHEMBL11666847 | 0.60 | KDM4E (0.45) | ALDH1A1 | |
| SCHEMBL1691833 | 0.59 | — | — | |
| SCHEMBL7294400 | 0.59 | HTR1A (0.44) | HTTTSHR | |
| SCHEMBL293154 | 0.58 | PARP1 (0.40) | MEN1KMT2AALDH1A1GABRA1GABRB2 |
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 |
|---|---|---|---|---|---|---|---|
| JP-53077096-A | — | — | None | — | — | JP | disclosed |
| JP-S5377096-A | PREPARATION OF THIENO 2,3-C QUINOLIN-4(5H)-ONE-7-ACETIC ACIDS | TEIJIN LTD | 1978-07-08 | — | — | JP | disclosed |