Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CRHBP | P24387 | 1/20 | 0.34 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1003717 | 0.84 | — | — | |
| SCHEMBL9650245 | 0.82 | CTSK (0.40) | NPSR1USP2ALDH1A1NPC1RAB9A | |
| SCHEMBL9650250 | 0.82 | CTSK (0.40) | NPSR1USP2ALDH1A1NPC1RAB9A | |
| SCHEMBL10779184 | 0.82 | CTSK (0.40) | NPSR1USP2ALDH1A1NPC1RAB9A | |
| SCHEMBL10568266 | 0.82 | CTSK (0.40) | NPSR1USP2ALDH1A1NPC1RAB9A | |
| SCHEMBL10779188 | 0.82 | CTSK (0.40) | NPSR1USP2ALDH1A1NPC1RAB9A | |
| SCHEMBL28159058 | 0.82 | CTSK (0.40) | NPSR1USP2ALDH1A1NPC1RAB9A | |
| SCHEMBL1004654 | 0.78 | — | — | |
| SCHEMBL9847189 | 0.73 | KCNJ1 (0.46) | TSHRNPSR1USP2ALDH1A1HPGD | |
| Benzonitrile SCHEMBL11596153 | 0.70 | TSHR (0.82) | TSHRALDH1A1MAPTMAOBMAOA |
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-0449648-B1 | Process for producing R(-)-mandelic acid and derivatives thereof | NITTO CHEMICAL INDUSTRY CO LTD (JP) | 1999-05-12 | — | — | EP | disclosed |
| EP-0449648-A2 | Process for producing R(-)-mandelic acid and derivatives thereof | NITTO CHEMICAL INDUSTRY CO., LTD. (JP) | 1991-10-02 | — | — | EP | disclosed |