Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | RXRA | P19793 | 1/20 | 0.35 |
| ▸ | RXRB | P28702 | 1/20 | 0.35 |
| ▸ | RXRG | P48443 | 1/20 | 0.35 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.34 |
| ▸ | APEX1 | P27695 | 1/20 | 0.34 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.34 |
| ▸ | RECQL | P46063 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11117698 | 0.97 | ALDH1A1 (0.40) | ALDH1A1KMT2AMEN1TP53TSHR | |
| SCHEMBL16823555 | 0.68 | ALDH1A1 (0.48) | ALDH1A1KMT2AMEN1TP53TSHR | |
| SCHEMBL28263510 | 0.65 | MAOA (0.59) | ALDH1A1KMT2AMEN1TP53TSHR | |
| SCHEMBL2783327 | 0.65 | ALDH1A1 (0.48) | ALDH1A1KMT2AMEN1TP53TSHR | |
| SCHEMBL8056506 | 0.65 | MEN1 (0.59) | ALDH1A1KMT2AMEN1 | |
| SCHEMBL12650247 | 0.64 | TSHR (0.50) | ALDH1A1TP53TSHRTDP1SRD5A2 | |
| Terephthalic Acid SCHEMBL2049859 | 0.63 | TSHR (0.71) | ALDH1A1TP53TSHRSRD5A2MAPT | |
| Terephthalic Acid SCHEMBL143079 | 0.63 | TSHR (0.92) | ALDH1A1TP53TSHRSRD5A2SMN1; SMN2 | |
| Terephthalic Acid SCHEMBL3691392 | 0.63 | TSHR (0.92) | ALDH1A1TP53TSHRSRD5A2SMN1; SMN2 | |
| SCHEMBL12493168 | 0.63 | WDR91 (0.53) | ALDH1A1TP53TSHRRXRASRD5A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0117413-A1 | D-Xylopyranoside series compounds and therapeutical compositions containing same | Seikagaku Kogyo Co. Ltd. (JP) | 1984-09-05 | — | — | EP | disclosed |
| EP-0053827-A2 | D-Xylopyranoside series compounds and therapeutical compositions containing same | Seikagaku Kogyo Co. Ltd. (JP) | 1982-06-16 | — | — | EP | disclosed |