Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.52 |
| ▸ | CA7 | P43166 | 6/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 6/20 | 0.52 |
| ▸ | CA9 | Q16790 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 5/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.41 |
| ▸ | CPA1 | P15085 | 1/20 | 0.40 |
| ▸ | ARG1 | P05089 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 2/20 | 0.40 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1134855 | 0.76 | CA12 (0.68) | CA12CA7CA14CA9CA2 | |
| Trifluoroacetic Acid SCHEMBL7346536 | 0.76 | ADAMTS4 (0.68) | HTTLMNAADAMTS4 | |
| Trifluoroacetic Acid SCHEMBL8444764 | 0.71 | ADAMTS4 (0.83) | ADAMTS4 | |
| N-Benzylmethylamine SCHEMBL30671659 | 0.71 | MAPT (0.63) | LMNACPA1 | |
| Trifluoroacetic Acid SCHEMBL1191360 | 0.70 | HDAC3 (0.60) | KMT2AMEN1CPA1 | |
| Trifluoroacetic Acid SCHEMBL27999393 | 0.70 | CES1 (0.53) | TSHRCPA1 | |
| SCHEMBL17335664 | 0.70 | CA12 (0.50) | CA12CA7CA14CA9CA2 | |
| SCHEMBL18697078 | 0.70 | SLC1A3 (0.60) | CA2CA1KMT2AHTTADAMTS4 | |
| SCHEMBL7475872 | 0.70 | SLC1A3 (0.60) | CA2CA1KMT2AHTTADAMTS4 | |
| SCHEMBL7462670 | 0.70 | SLC1A3 (0.60) | CA2CA1KMT2AHTTADAMTS4 |
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-1998043962-A1 | HETEROCYCLIC INTEGRIN INHIBITOR PRODRUGS | DU PONT PHARMACEUTICALS COMPANY (US) | 1998-10-08 | — | — | WO | disclosed |