Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 2/20 | 0.50 |
| ▸ | GSTM2 | P28161 | 2/20 | 0.50 |
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.43 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.43 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6536280 | 0.84 | ALDH1A1 (0.57) | GSTP1GSTM2ERN1ALDH1A1MEN1 | |
| SCHEMBL8398603 | 0.80 | ERN1 (0.46) | ERN1CYP19A1ALDH1A1MEN1KMT2A | |
| SCHEMBL8399950 | 0.80 | ERN1 (0.46) | ERN1CYP19A1ALDH1A1MEN1KMT2A | |
| SCHEMBL10488789 | 0.78 | CYP1A2 (0.48) | ALDH1A1CYP1A2POLBCYP2C19 | |
| SCHEMBL7278367 | 0.78 | CYP3A4 (0.49) | ERN1ALDH1A1MEN1KMT2AMAPT | |
| SCHEMBL6987550 | 0.77 | CYP19A1 (0.59) | ERN1CYP19A1CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL7276534 | 0.77 | HTR1A (0.47) | ALDH1A1MEN1KMT2ACYP1A2CYP2C9 | |
| SCHEMBL3067225 | 0.76 | ERN1 (0.53) | ERN1ALDH1A1NPC1MAPTCYP1A2 | |
| SCHEMBL11707841 | 0.76 | ALDH1A1 (0.64) | GSTP1GSTM2ALDH1A1MEN1KMT2A | |
| SCHEMBL11359331 | 0.75 | PDE7A (0.61) | GSTP1GSTM2ALDH1A1MEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5994563-A | THIOPHENE DERIVATIVES, IMMUNOSUPPRESSANTS | ORTHO PHARMACEUTICAL CORPORATION (US) | 1999-11-30 | — | — | US | disclosed |