Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | NNMT | P40261 | 1/20 | 0.41 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | IKBKB | O14920 | 1/20 | 0.41 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.41 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.41 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23792950 | 0.86 | TSHR (0.50) | TSHRALDH1A1HPGDKMT2AHTT | |
| SCHEMBL6941556 | 0.84 | MAPK1 (0.72) | MAPK1TSHRHPGDTP53PRSS1 | |
| SCHEMBL17129602 | 0.84 | L3MBTL1 (0.57) | TSHRTDP1L3MBTL1KDM4EALDH1A1 | |
| SCHEMBL15101072 | 0.82 | MAPK1 (0.69) | MAPK1TSHRKDM4EKMT2AHTT | |
| SCHEMBL30151541 | 0.80 | MAPK1 (0.50) | MAPK1CHEK2KDM4EALDH1A1HPGD | |
| SCHEMBL3340955 | 0.80 | MAPK1 (0.60) | MAPK1TSHRL3MBTL1ALDH1A1KMT2A | |
| SCHEMBL8901308 | 0.79 | MAPK1 (0.49) | MAPK1CHEK2KDM4EALDH1A1HPGD | |
| SCHEMBL31053926 | 0.78 | MAPK1 (0.63) | MAPK1TSHRKMT2ATP53MEN1 | |
| SCHEMBL2936694 | 0.78 | TSHR (0.53) | TSHRTDP1ALDH1A1HPGDKMT2A | |
| SCHEMBL2934574 | 0.77 | TDP1 (0.52) | TSHRTDP1L3MBTL1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-5215738-A | Used for destroying hypoxic tumor cells | SRI INTERNATIONAL (US) | 1993-06-01 | — | — | US | disclosed |
| WO-1986006628-A1 | BENZAMIDE AND NICOTINAMIDE RADIOSENSITIZERS | SRI INTERNATIONAL (US) | 1986-11-20 | — | — | WO | disclosed |