Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYCR1 | P32322 | 4/20 | 0.39 |
| ▸ | MAOA | P21397 | 4/20 | 0.39 |
| ▸ | MAOB | P27338 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | POLQ | O75417 | 1/20 | 0.35 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29009675 | 0.75 | TP53 (0.41) | LMNACYP3A4TSHRALDH1A1SMN1; SMN2 | |
| SCHEMBL29009648 | 0.73 | KMT2A (0.44) | CYP3A4ALDH1A1SMN1; SMN2TRPM8 | |
| SCHEMBL16054223 | 0.72 | MEN1 (0.40) | TSHRSMN1; SMN2TRPM8 | |
| SCHEMBL1951077 | 0.71 | CYP1A2 (0.43) | LMNACYP3A4ALDH1A1SMN1; SMN2TRPM8 | |
| SCHEMBL1018866 | 0.71 | POLQ (0.39) | PYCR1MAOAMAOBLMNAUSP2 | |
| SCHEMBL29009676 | 0.71 | TP53 (0.49) | ALDH1A1 | |
| SCHEMBL10784051 | 0.70 | POLQ (0.46) | PYCR1MAOAMAOBLMNAUSP2 | |
| SCHEMBL16054824 | 0.70 | MEN1 (0.35) | TSHRALDH1A1SMN1; SMN2TRPM8 | |
| SCHEMBL11480104 | 0.67 | KDM4E (0.38) | MAOAMAOBCYP3A4 | |
| SCHEMBL2092009 | 0.67 | CA12 (0.41) | USP2TSHRALDH1A1SMN1; SMN2 |
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-5354777-A | Cyanoalkene derivatives, process for their preparation, and their use as microbicide for the protection of materials | BAYER AKTIENGESELLSCHAFT (DE) | 1994-10-11 | — | — | US | disclosed |