Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HBB | P68871 | 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 | |
|---|---|---|---|---|
| SCHEMBL5094054 | 0.84 | ALDH1A1 (0.51) | ALDH1A1RAB9AUSP2POLBHPGD | |
| SCHEMBL6497565 | 0.77 | ALDH1A1 (0.40) | ALDH1A1RAB9AUSP2POLBHPGD | |
| SCHEMBL5100418 | 0.75 | ALDH1A1 (0.35) | ALDH1A1RAB9AUSP2POLBHPGD | |
| SCHEMBL5094079 | 0.72 | RAB9A (0.47) | ALDH1A1RAB9AUSP2POLBHPGD | |
| SCHEMBL736037 | 0.71 | — | — | |
| SCHEMBL15483342 | 0.71 | HTR1A (0.31) | ALDH1A1 | |
| SCHEMBL20769654 | 0.69 | TSHR (0.43) | ALDH1A1RAB9APOLBHPGDMAPT | |
| SCHEMBL20216193 | 0.69 | HDAC3 (0.34) | ALDH1A1 | |
| SCHEMBL14920499 | 0.69 | — | — | |
| SCHEMBL19745654 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0189960-B1 | NOVEL INSECTICIDAL 1,3-THIAZOLE DERIVATIVES | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1991-04-24 | — | — | EP | disclosed |
| US-4626543-A | PARTICULARY MOTHS | SHELL OIL COMPANY (US) | 1986-12-02 | — | — | US | disclosed |
| EP-0189960-A2 | Novel insecticidal 1,3-thiazole derivatives | SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) | 1986-08-06 | — | — | EP | disclosed |