Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | PTGER3 | P43115 | 3/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 3/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | THRA | P10827 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.34 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.34 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9338260 | 0.96 | SLC16A3 (0.40) | SLC16A3SMN1; SMN2THRATHRBLIPG | |
| SCHEMBL9341961 | 0.95 | SLC16A3 (0.41) | SLC16A3THRATHRBLIPG | |
| SCHEMBL9341673 | 0.92 | SMN1; SMN2 (0.39) | SLC16A3SMN1; SMN2PTGER3PTGER2PTGER4 | |
| SCHEMBL10497563 | 0.90 | THRA (0.45) | THRATHRBLIPG | |
| SCHEMBL9338280 | 0.88 | SMN1; SMN2 (0.42) | SLC16A3SMN1; SMN2PTGER3PTGER2PTGER4 | |
| SCHEMBL10497772 | 0.85 | THRA (0.45) | THRATHRB | |
| SCHEMBL9338419 | 0.81 | SMN1; SMN2 (0.36) | SLC16A3SMN1; SMN2THRBHDAC3HDAC4 | |
| SCHEMBL10585548 | 0.80 | PTGER3 (0.37) | SMN1; SMN2PTGER3PTGER2PTGER4TBXA2R | |
| SCHEMBL9791128 | 0.79 | PTGER3 (0.41) | PTGER3PTGER2PTGER4CYP3A4CYP2D6 | |
| SCHEMBL9791124 | 0.79 | PTGER3 (0.41) | PTGER3PTGER2PTGER4CYP3A4CYP2D6 |
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-0328668-B1 | NONLINEAR OPTICAL MATERIAL | NIPPON OILS & FATS CO LTD (JP) | 1994-05-25 | — | — | EP | disclosed |
| US-5045239-A | Chalcone derivative | NIPPON OIL AND FATS CO., LTD. (JP) | 1991-09-03 | — | — | US | disclosed |
| EP-0328668-A1 | NONLINEAR OPTICAL MATERIAL | NIPPON OIL AND FATS COMPANY, LIMITED (JP) | 1989-08-23 | — | — | EP | disclosed |