Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 4/20 | 0.88 |
| ▸ | PARP10 | Q53GL7 | 2/20 | 0.69 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.69 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 3/20 | 0.59 |
| ▸ | DAO | P14920 | 1/20 | 0.59 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.58 |
| ▸ | FEN1 | P39748 | 1/20 | 0.58 |
| ▸ | TTR | P02766 | 1/20 | 0.58 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | LTA4H | P09960 | 1/20 | 0.57 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.57 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL1888572 | 1.00 | SRD5A2 (0.88) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| SCHEMBL200428 | 1.00 | SRD5A2 (0.88) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| Ammonia Solution, Strong SCHEMBL18151747 | 0.98 | SRD5A2 (0.84) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| Hydrochloric Acid SCHEMBL10520761 | 0.98 | SRD5A2 (0.84) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| Diphenylether SCHEMBL27807374 | 0.98 | SRD5A2 (0.83) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| Diphenylether SCHEMBL17104399 | 0.95 | SRD5A2 (0.80) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| Benzoic Acid SCHEMBL3021235 | 0.95 | SRD5A2 (0.80) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| SCHEMBL8999835 | 0.94 | SRD5A2 (0.78) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| SCHEMBL7822422 | 0.94 | SRD5A2 (1.00) | SRD5A2PARP10PARP15PKMAKR1C3 | |
| Diphenylether SCHEMBL1926311 | 0.93 | SRD5A2 (0.76) | SRD5A2PARP10PARP15PKMAKR1C3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1126833-A4 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES INC (US) | 2004-09-08 | — | — | EP | disclosed |
| EP-1126833-A2 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2001-08-29 | — | — | EP | disclosed |
| WO-2000025768-A1 | OXADIAZOLE, THIADIAZOLE AND TRIAZOLE DERIVATIVES AND COMBINATORIAL LIBRARIES THEREOF | TREGA BIOSCIENCES, INC. (US) | 2000-05-11 | — | — | WO | disclosed |