Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CTSS | P25774 | 7/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8305436 | 0.89 | CACNA1B (0.44) | GAATSHRPOLBSMN1; SMN2 | |
| SCHEMBL8308565 | 0.82 | CTSL (0.51) | GAACTSSKMT2AALDH1A1POLB | |
| SCHEMBL7357371 | 0.80 | CYP3A4 (0.49) | CYP3A4CYP2C19GAACTSSTSHR | |
| SCHEMBL19839941 | 0.76 | AIMP2 (0.55) | CYP3A4CYP2C19GAACTSSTSHR | |
| SCHEMBL30597934 | 0.76 | AIMP2 (0.55) | CYP3A4CYP2C19GAACTSSTSHR | |
| SCHEMBL7363254 | 0.72 | CAPN9 (0.51) | CYP3A4CAPN1POLBLMNA | |
| SCHEMBL7030374 | 0.71 | POLB (0.68) | GAACTSSCAPN1POLBPKM | |
| SCHEMBL7030377 | 0.71 | POLB (0.68) | GAACTSSCAPN1POLBPKM | |
| SCHEMBL7397775 | 0.70 | GAA (0.48) | CYP3A4GAATSHRMEN1KMT2A | |
| SCHEMBL11209259 | 0.70 | CAPN1 (0.60) | GAATSHRMEN1KMT2ACAPN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0753003-B1 | AZIRIDINE DERIVATIVES, THEIR PRODUCTION AND USE | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1999-06-16 | — | — | EP | disclosed |
| US-5668128-A | INHIBITORS OF THIOL PROTEASE, PROPHYLAXIS AND TREATMENT OF BONE DISEASES, OSTEOPOROSIS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-09-16 | — | — | US | disclosed |