Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.39 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.39 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL5148269 | 0.89 | ALDH1A1 (0.45) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL3807003 | 0.81 | KDM4E (0.45) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL57737 | 0.79 | ALDH1A1 (0.58) | ALDH1A1KMT2AMEN1TDP1L3MBTL1 | |
| SCHEMBL57738 | 0.79 | ALDH1A1 (0.58) | ALDH1A1KMT2AMEN1TDP1L3MBTL1 | |
| SCHEMBL11318163 | 0.78 | ALDH1A1 (0.61) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL48361 | 0.78 | GPR35 (0.53) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL48360 | 0.78 | GPR35 (0.53) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL5147271 | 0.77 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL12086518 | 0.76 | ALDH1A1 (0.44) | ALDH1A1KMT2AMEN1TSHRTDP1 | |
| SCHEMBL2292100 | 0.76 | TSHR (0.58) | ALDH1A1KMT2AMEN1TSHRTDP1 |
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-2164480-A1 | MUTUAL PRODRUGS AND METHODS TO TREAT CANCER | University of Maryland, Baltimore (US) | 2010-03-24 | — | — | EP | disclosed |
| WO-2008154372-A1 | MUTUAL PRODRUGS AND METHODS TO TREAT CANCER | UNIVERSITY OF MARYLAND, BALTIMORE (US) | 2008-12-18 | — | — | WO | disclosed |