Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.70 |
| ▸ | NPC1 | O15118 | 5/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.70 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.70 |
| ▸ | LMNA | P02545 | 3/20 | 0.70 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.70 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.70 |
| ▸ | RELA | Q04206 | 2/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | PARP1 | P09874 | 1/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.56 |
| ▸ | FSCN1 | Q16658 | 1/20 | 0.56 |
| ▸ | MMP1 | P03956 | 3/20 | 0.55 |
| ▸ | MMP2 | P08253 | 3/20 | 0.55 |
| ▸ | MMP9 | P14780 | 3/20 | 0.55 |
| ▸ | EGFR | P00533 | 1/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6380999 | 1.00 | RAB9A (0.70) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL28645446 | 0.85 | NPC1 (0.61) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL31188414 | 0.85 | NPC1 (0.61) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL14757343 | 0.82 | NPC1 (1.00) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL13212221 | 0.81 | AKT1 (0.64) | KDM4ELMNAKMT2AALDH1A1MAPT | |
| SCHEMBL19974323 | 0.80 | NPC1 (0.58) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL19974322 | 0.80 | NPC1 (0.58) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL18292499 | 0.73 | LMNA (0.65) | KDM4ELMNAKMT2AALDH1A1MAPT | |
| SCHEMBL3379803 | 0.73 | AQP4 (0.70) | RAB9ANPC1KDM4ESMN1; SMN2LMNA | |
| SCHEMBL28825761 | 0.73 | LMNA (0.48) | RAB9ANPC1KDM4ESMN1; SMN2LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005072731-A1 | 3-PHENYL-N- ((1, 3, 4) THIADIAZOL-2-YL) -ACRYLAMIDE DERIVATIVES AND RELATED COMPOUNDS AS MODULATORS OF ESTROGEN-RELATED RECEPTORS FOR THE TREATMENT OF E.G. CANCER, RHEUMATOID ARTHRITIS OR NEUROLOGICAL DISORDERS | X-CEPTOR THERAPEUTICS, INC. (US) | 2005-08-11 | — | — | WO | disclosed |