Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 2/20 | 0.69 |
| ▸ | AKR1C3 | P42330 | 4/20 | 0.67 |
| ▸ | AKR1C4 | P17516 | 2/20 | 0.67 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.67 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.67 |
| ▸ | PPARD | Q03181 | 3/20 | 0.64 |
| ▸ | PPARG | P37231 | 3/20 | 0.64 |
| ▸ | PPARA | Q07869 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 5/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 2/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.61 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.61 |
| ▸ | RGS12 | O14924 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | PKM | P14618 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL20769739 | 0.91 | PLA2G2A (0.83) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL3030239 | 0.89 | MTNR1A (0.61) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL11332785 | 0.87 | MTNR1A (0.59) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL20769719 | 0.86 | ALDH1A1 (0.65) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL7053553 | 0.84 | CACNB4 (0.62) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL8171657 | 0.82 | KEAP1 (0.57) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL10946754 | 0.82 | AKR1C3 (0.69) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 | |
| SCHEMBL7692305 | 0.82 | CHRM1 (0.65) | PLA2G2APPARDPPARGPPARALMNA | |
| SCHEMBL7963252 | 0.81 | PLA2G2A (1.00) | PLA2G2APPARDPPARGPPARALMNA | |
| Methoxyacetic Acid SCHEMBL9738426 | 0.81 | LMNA (0.55) | PLA2G2AAKR1C3AKR1C4PTGS1AKR1C2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002020478-A1 | N-BENZYLINDOLE-3-ACETIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF DRUG RESISTAN CANCER | DUBLIN CITY UNIVERSITY (IE) | 2002-03-14 | — | — | WO | claimed |
| WO-2002020478-A1 | N-BENZYLINDOLE-3-ACETIC ACID DERIVATIVES FOR USE IN THE TREATMENT OF DRUG RESISTAN CANCER | DUBLIN CITY UNIVERSITY (IE) | 2002-03-14 | — | — | WO | disclosed |