Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP12 | P39900 | 3/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.50 |
| ▸ | MMP14 | P50281 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.47 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.45 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CPA1 | P15085 | 2/20 | 0.44 |
| ▸ | CPB1 | P15086 | 1/20 | 0.44 |
| ▸ | CPA3 | P15088 | 1/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL18261174 | 0.89 | MMP12 (0.42) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL18065715 | 0.89 | MMP12 (0.56) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL27505502 | 0.88 | MAPT (0.50) | MMP2S1PR2S1PR1KMT2ASMN1; SMN2 | |
| SCHEMBL4076046 | 0.88 | MMP12 (0.49) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL10488291 | 0.84 | MMP12 (0.51) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL9426583 | 0.82 | TP53 (0.46) | TSHRSMN1; SMN2HPGD | |
| SCHEMBL8100431 | 0.82 | TP53 (0.46) | TSHRHPGD | |
| SCHEMBL5237256 | 0.82 | MMP12 (0.50) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL24925 | 0.82 | MMP12 (0.50) | MMP12MMP2MMP9MMP13MMP14 | |
| SCHEMBL21121200 | 0.81 | CPA1 (0.56) | KEAP1CPA1CPB1CPA3CPB2 |
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-6543181-B1 | Mixture of volatile acid, alcohol and nitrogen compound | IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. | 2003-04-08 | — | — | US | disclosed |